(S)-methyl 3-(1H-indol-3-yl)-2-(3-(2-methoxyphenyl)ureido)propanoate
TL;DR: (S)-methyl 3-(1H-indol-3-yl)-2-(3-(2-methoxyphenyl)ureido)propanoate (CAS 958984-16-2) is a chemical compound with molecular formula C20H21N3O4 and molecular weight 367.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S)-3-(1H-indol-3-yl)-2-[(2-methoxyphenyl)carbamoylamino]propanoate
Also Known As: (S)-methyl 3-(1H-indol-3-yl)-2-(3-(2-methoxyphenyl)ureido)propanoate, (S)-3-(1H-Indol-3-yl)-2-[3-(2-methoxy-phenyl)-ureido]-propionic acid methyl ester, methyl (2S)-3-(1H-indol-3-yl)-2-[(2-methoxyphenyl)carbamoylamino]propanoate
| Molecular Formula | C20H21N3O4 |
|---|---|
| Molecular Weight | 367.15 g/mol |
| LogP | 3.0823 |
| Topological Polar Surface Area | 92.45 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 367.1532 |
| Heavy Atoms | 27 |
| Complexity | 951.05963 |
Chemical Identifiers
| CAS Number | 958984-16-2 |
|---|---|
| SMILES | COC1=CC=CC=C1NC(=O)N[C@@H](CC2=CNC3=CC=CC=C32)C(=O)OC |
Product Overview
(S)-methyl 3-(1H-indol-3-yl)-2-(3-(2-methoxyphenyl)ureido)propanoate (CAS 958984-16-2), with molecular formula C20H21N3O4 and molecular weight 367.15 g/mol. IUPAC: methyl (2S)-3-(1H-indol-3-yl)-2-[(2-methoxyphenyl)carbamoylamino]propanoate.
Chemical Property Profile of (S)-methyl 3-(1H-indol-3-yl)-2-(3-(2-methoxyphenyl)ureido)propanoate
Property Insights of (S)-methyl 3-(1H-indol-3-yl)-2-(3-(2-methoxyphenyl)ureido)propanoate
The XLogP value of 3.0823 indicates that (S)-methyl 3-(1H-indol-3-yl)-2-(3-(2-methoxyphenyl)ureido)propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.45 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-methyl 3-(1H-indol-3-yl)-2-(3-(2-methoxyphenyl)ureido)propanoate. Following Lipinski's Rule of Five, (S)-methyl 3-(1H-indol-3-yl)-2-(3-(2-methoxyphenyl)ureido)propanoate has 3 hydrogen bond donor(s) and 4 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 (S)-methyl 3-(1H-indol-3-yl)-2-(3-(2-methoxyphenyl)ureido)propanoate?
The CAS number of (S)-methyl 3-(1H-indol-3-yl)-2-(3-(2-methoxyphenyl)ureido)propanoate is 958984-16-2.
What is the molecular formula of (S)-methyl 3-(1H-indol-3-yl)-2-(3-(2-methoxyphenyl)ureido)propanoate?
The molecular formula of (S)-methyl 3-(1H-indol-3-yl)-2-(3-(2-methoxyphenyl)ureido)propanoate is C20H21N3O4.
What is the molecular weight of (S)-methyl 3-(1H-indol-3-yl)-2-(3-(2-methoxyphenyl)ureido)propanoate?
The molecular weight of (S)-methyl 3-(1H-indol-3-yl)-2-(3-(2-methoxyphenyl)ureido)propanoate is 367.15 g/mol.
Where can I buy (S)-methyl 3-(1H-indol-3-yl)-2-(3-(2-methoxyphenyl)ureido)propanoate?
You can request a quote for (S)-methyl 3-(1H-indol-3-yl)-2-(3-(2-methoxyphenyl)ureido)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-methyl 3-(1H-indol-3-yl)-2-(3-(2-methoxyphenyl)ureido)propanoate?
Yes, KEHONG BIO provides custom synthesis services for (S)-methyl 3-(1H-indol-3-yl)-2-(3-(2-methoxyphenyl)ureido)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.