Phosphoramidothioic acid, ethyl(2-((1-methylethyl)phenylamino)-2-oxoethyl)-, O,O-diethyl ester, mixted with triforine and carbendazin
TL;DR: Phosphoramidothioic acid, ethyl(2-((1-methylethyl)phenylamino)-2-oxoethyl)-, O,O-diethyl ester, mixted with triforine and carbendazin (CAS 123615-80-5) is a chemical compound with molecular formula C36H52Cl6N9O7PS and molecular weight 995.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[diethoxyphosphinothioyl(ethyl)amino]-N-phenyl-N-propan-2-ylacetamide;methyl N-(1H-benzimidazol-2-yl)carbamate;N-[2,2,2-trichloro-1-[4-(2,2,2-trichloro-1-formamidoethyl)piperazin-1-yl]ethyl]formamide
Also Known As: Phosphoramidothioic acid, ethyl(2-((1-methylethyl)phenylamino)-2-oxoethyl)-, O,O-diethyl ester, mixted with triforine and carbendazin, 2-(diethoxyphosphinothioyl-ethyl-amino)-N-phenyl-N-propan-2-yl-acetamide; methyl N-(1H-benzoimidazol-2-yl)carbamate; N-[2,2,2-trichloro-1-[4-(2,2,2-trichloro-1-formamido-ethyl)piperazin-1-yl]ethyl]formamide, 2-[diethoxyphosphinothioyl(ethyl)amino]-N-phenyl-N-propan-2-ylacetamide; methyl N-(1H-benzimidazol-2-yl)carbamate; N-[2,2,2-trichloro-1-[4-(2,2,2-trichloro-1-formamidoethyl)piperazin-1-yl]ethyl]formamide, Carbamic acid, 1H-benzimidazol-2-yl-, methyl ester, mixt. with O,O-diethyl ethyl(2-((1-methylethyl)phenylamino)-2-oxoethyl)phosphoramidothioate and N,N'-(1,4-piperazinediylbis(2,2,2-trichloroethylidene))bis(formamide)
| Molecular Formula | C36H52Cl6N9O7PS |
|---|---|
| Molecular Weight | 995.16 g/mol |
| LogP | 7.2772 |
| Topological Polar Surface Area | 206.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 16 |
| Exact Mass | 995.1579 |
| Heavy Atoms | 60 |
| Complexity | 985.0 |
Chemical Identifiers
| CAS Number | 123615-80-5 |
|---|---|
| SMILES | CCN(CC(=O)N(C1=CC=CC=C1)C(C)C)P(=S)(OCC)OCC.COC(=O)NC1=NC2=CC=CC=C2N1.C1CN(CCN1C(C(Cl)(Cl)Cl)NC=O)C(C(Cl)(Cl)Cl)NC=O |
| InChIKey | GLRQKGITRVEZEM-UHFFFAOYSA-N |
Product Overview
Phosphoramidothioic acid, ethyl(2-((1-methylethyl)phenylamino)-2-oxoethyl)-, O,O-diethyl ester, mixted with triforine and carbendazin (CAS 123615-80-5), with molecular formula C36H52Cl6N9O7PS and molecular weight 995.16 g/mol. IUPAC: 2-[diethoxyphosphinothioyl(ethyl)amino]-N-phenyl-N-propan-2-ylacetamide;methyl N-(1H-benzimidazol-2-yl)carbamate;N-[2,2,2-trichloro-1-[4-(2,2,2-trichloro-1-formamidoethyl)piperazin-1-yl]ethyl]formamide.
Chemical Property Profile of Phosphoramidothioic acid, ethyl(2-((1-methylethyl)phenylamino)-2-oxoethyl)-, O,O-diethyl ester, mixted with triforine and carbendazin
Property Insights of Phosphoramidothioic acid, ethyl(2-((1-methylethyl)phenylamino)-2-oxoethyl)-, O,O-diethyl ester, mixted with triforine and carbendazin
The XLogP value of 7.2772 indicates that Phosphoramidothioic acid, ethyl(2-((1-methylethyl)phenylamino)-2-oxoethyl)-, O,O-diethyl ester, mixted with triforine and carbendazin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 206.0 Ų indicates high polarity, suggesting Phosphoramidothioic acid, ethyl(2-((1-methylethyl)phenylamino)-2-oxoethyl)-, O,O-diethyl ester, mixted with triforine and carbendazin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Phosphoramidothioic acid, ethyl(2-((1-methylethyl)phenylamino)-2-oxoethyl)-, O,O-diethyl ester, mixted with triforine and carbendazin has 4 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phosphoramidothioic acid, ethyl(2-((1-methylethyl)phenylamino)-2-oxoethyl)-, O,O-diethyl ester, mixted with triforine and carbendazin?
The CAS number of Phosphoramidothioic acid, ethyl(2-((1-methylethyl)phenylamino)-2-oxoethyl)-, O,O-diethyl ester, mixted with triforine and carbendazin is 123615-80-5.
What is the molecular formula of Phosphoramidothioic acid, ethyl(2-((1-methylethyl)phenylamino)-2-oxoethyl)-, O,O-diethyl ester, mixted with triforine and carbendazin?
The molecular formula of Phosphoramidothioic acid, ethyl(2-((1-methylethyl)phenylamino)-2-oxoethyl)-, O,O-diethyl ester, mixted with triforine and carbendazin is C36H52Cl6N9O7PS.
What is the molecular weight of Phosphoramidothioic acid, ethyl(2-((1-methylethyl)phenylamino)-2-oxoethyl)-, O,O-diethyl ester, mixted with triforine and carbendazin?
The molecular weight of Phosphoramidothioic acid, ethyl(2-((1-methylethyl)phenylamino)-2-oxoethyl)-, O,O-diethyl ester, mixted with triforine and carbendazin is 995.16 g/mol.
Where can I buy Phosphoramidothioic acid, ethyl(2-((1-methylethyl)phenylamino)-2-oxoethyl)-, O,O-diethyl ester, mixted with triforine and carbendazin?
You can request a quote for Phosphoramidothioic acid, ethyl(2-((1-methylethyl)phenylamino)-2-oxoethyl)-, O,O-diethyl ester, mixted with triforine and carbendazin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphoramidothioic acid, ethyl(2-((1-methylethyl)phenylamino)-2-oxoethyl)-, O,O-diethyl ester, mixted with triforine and carbendazin?
Yes, KEHONG BIO provides custom synthesis services for Phosphoramidothioic acid, ethyl(2-((1-methylethyl)phenylamino)-2-oxoethyl)-, O,O-diethyl ester, mixted with triforine and carbendazin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.