1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(5-CHLORO-2-METHOXYPHENYL)THIOSEMICARBAZIDE
TL;DR: 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(5-CHLORO-2-METHOXYPHENYL)THIOSEMICARBAZIDE (CAS 1024183-79-6) is a chemical compound with molecular formula C20H22ClN3O4S and molecular weight 435.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-chloro-2-methoxyphenyl)-3-[[2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]acetyl]amino]thiourea
Also Known As: 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(5-CHLORO-2-METHOXYPHENYL)THIOSEMICARBAZIDE, 1-(5-chloro-2-methoxyphenyl)-3-[[2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]acetyl]amino]thiourea, N-{[(5-chloro-2-methoxyphenyl)carbamothioyl]amino}-2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]acetamide, 1-(5-chloro-2-methoxy-phenyl)-3-[[2-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]acetyl]amino]thiourea, 3-(5-chloro-2-methoxy-phenyl)-1-[[2-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]acetyl]amino]thiourea
| Molecular Formula | C20H22ClN3O4S |
|---|---|
| Molecular Weight | 435.10 g/mol |
| LogP | 3.4587 |
| Topological Polar Surface Area | 80.85 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 435.10196 |
| Heavy Atoms | 29 |
| Complexity | 935.9375 |
Chemical Identifiers
| CAS Number | 1024183-79-6 |
|---|---|
| SMILES | CC1(CC2=C(O1)C(=CC=C2)OCC(=O)NNC(=S)NC3=C(C=CC(=C3)Cl)OC)C |
Product Overview
1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(5-CHLORO-2-METHOXYPHENYL)THIOSEMICARBAZIDE (CAS 1024183-79-6), with molecular formula C20H22ClN3O4S and molecular weight 435.10 g/mol. IUPAC: 1-(5-chloro-2-methoxyphenyl)-3-[[2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]acetyl]amino]thiourea.
Chemical Property Profile of 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(5-CHLORO-2-METHOXYPHENYL)THIOSEMICARBAZIDE
Property Insights of 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(5-CHLORO-2-METHOXYPHENYL)THIOSEMICARBAZIDE
The XLogP value of 3.4587 indicates that 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(5-CHLORO-2-METHOXYPHENYL)THIOSEMICARBAZIDE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.85 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(5-CHLORO-2-METHOXYPHENYL)THIOSEMICARBAZIDE. Following Lipinski's Rule of Five, 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(5-CHLORO-2-METHOXYPHENYL)THIOSEMICARBAZIDE has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(5-CHLORO-2-METHOXYPHENYL)THIOSEMICARBAZIDE?
The CAS number of 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(5-CHLORO-2-METHOXYPHENYL)THIOSEMICARBAZIDE is 1024183-79-6.
What is the molecular formula of 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(5-CHLORO-2-METHOXYPHENYL)THIOSEMICARBAZIDE?
The molecular formula of 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(5-CHLORO-2-METHOXYPHENYL)THIOSEMICARBAZIDE is C20H22ClN3O4S.
What is the molecular weight of 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(5-CHLORO-2-METHOXYPHENYL)THIOSEMICARBAZIDE?
The molecular weight of 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(5-CHLORO-2-METHOXYPHENYL)THIOSEMICARBAZIDE is 435.10 g/mol.
Where can I buy 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(5-CHLORO-2-METHOXYPHENYL)THIOSEMICARBAZIDE?
You can request a quote for 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(5-CHLORO-2-METHOXYPHENYL)THIOSEMICARBAZIDE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(5-CHLORO-2-METHOXYPHENYL)THIOSEMICARBAZIDE?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(5-CHLORO-2-METHOXYPHENYL)THIOSEMICARBAZIDE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.