![methyl 4-[({[(4-methoxyphenyl)carbamothioyl]amino}carbamoyl)methoxy]benzoate structure](/static/products/1022/1022591-11-2.webp)
methyl 4-[({[(4-methoxyphenyl)carbamothioyl]amino}carbamoyl)methoxy]benzoate
TL;DR: methyl 4-[({[(4-methoxyphenyl)carbamothioyl]amino}carbamoyl)methoxy]benzoate (CAS 1022591-11-2) is a chemical compound with molecular formula C18H19N3O5S and molecular weight 389.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[2-[2-[(4-methoxyphenyl)carbamothioyl]hydrazinyl]-2-oxoethoxy]benzoate
Also Known As: methyl 4-[({[(4-methoxyphenyl)carbamothioyl]amino}carbamoyl)methoxy]benzoate, methyl 4-(2-{2-[(4-methoxyanilino)carbothioyl]hydrazino}-2-oxoethoxy)benzenecarboxylate, methyl 4-[2-[2-[(4-methoxyphenyl)carbamothioyl]hydrazinyl]-2-oxoethoxy]benzoate, METHYL 4-((N-((((4-METHOXYPHENYL)AMINO)THIOXOMETHYL)AMINO)CARBAMOYL)METHOXY)BENZOATE, Methyl 4-[[(4-methoxyphenyl)thiocarbamoylamino]carbamoylmethoxy]benzoate
| Molecular Formula | C18H19N3O5S |
|---|---|
| Molecular Weight | 389.10 g/mol |
| LogP | 1.8784 |
| Topological Polar Surface Area | 97.92 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 389.10455 |
| Heavy Atoms | 27 |
| Complexity | 793.64935 |
Chemical Identifiers
| CAS Number | 1022591-11-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=S)NNC(=O)COC2=CC=C(C=C2)C(=O)OC |
Product Overview
methyl 4-[({[(4-methoxyphenyl)carbamothioyl]amino}carbamoyl)methoxy]benzoate (CAS 1022591-11-2), with molecular formula C18H19N3O5S and molecular weight 389.10 g/mol. IUPAC: methyl 4-[2-[2-[(4-methoxyphenyl)carbamothioyl]hydrazinyl]-2-oxoethoxy]benzoate.
Chemical Property Profile of methyl 4-[({[(4-methoxyphenyl)carbamothioyl]amino}carbamoyl)methoxy]benzoate
Property Insights of methyl 4-[({[(4-methoxyphenyl)carbamothioyl]amino}carbamoyl)methoxy]benzoate
The XLogP value of 1.8784 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 4-[({[(4-methoxyphenyl)carbamothioyl]amino}carbamoyl)methoxy]benzoate. The TPSA of 97.92 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 4-[({[(4-methoxyphenyl)carbamothioyl]amino}carbamoyl)methoxy]benzoate. Following Lipinski's Rule of Five, methyl 4-[({[(4-methoxyphenyl)carbamothioyl]amino}carbamoyl)methoxy]benzoate has 3 hydrogen bond donor(s) and 6 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 methyl 4-[({[(4-methoxyphenyl)carbamothioyl]amino}carbamoyl)methoxy]benzoate?
The CAS number of methyl 4-[({[(4-methoxyphenyl)carbamothioyl]amino}carbamoyl)methoxy]benzoate is 1022591-11-2.
What is the molecular formula of methyl 4-[({[(4-methoxyphenyl)carbamothioyl]amino}carbamoyl)methoxy]benzoate?
The molecular formula of methyl 4-[({[(4-methoxyphenyl)carbamothioyl]amino}carbamoyl)methoxy]benzoate is C18H19N3O5S.
What is the molecular weight of methyl 4-[({[(4-methoxyphenyl)carbamothioyl]amino}carbamoyl)methoxy]benzoate?
The molecular weight of methyl 4-[({[(4-methoxyphenyl)carbamothioyl]amino}carbamoyl)methoxy]benzoate is 389.10 g/mol.
Where can I buy methyl 4-[({[(4-methoxyphenyl)carbamothioyl]amino}carbamoyl)methoxy]benzoate?
You can request a quote for methyl 4-[({[(4-methoxyphenyl)carbamothioyl]amino}carbamoyl)methoxy]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 4-[({[(4-methoxyphenyl)carbamothioyl]amino}carbamoyl)methoxy]benzoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 4-[({[(4-methoxyphenyl)carbamothioyl]amino}carbamoyl)methoxy]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.