methyl N-{[3-(ethoxycarbonyl)phenyl]carbamoyl}-L-leucinate
TL;DR: methyl N-{[3-(ethoxycarbonyl)phenyl]carbamoyl}-L-leucinate (CAS 1173673-91-0) is a chemical compound with molecular formula C17H24N2O5 and molecular weight 336.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[[(2S)-1-methoxy-4-methyl-1-oxopentan-2-yl]carbamoylamino]benzoate
Also Known As: methyl N-{[3-(ethoxycarbonyl)phenyl]carbamoyl}-L-leucinate, (S)-ethyl 3-(3-(1-methoxy-4-methyl-1-oxopentan-2-yl)ureido)benzoate, ethyl 3-[[(2S)-1-methoxy-4-methyl-1-oxopentan-2-yl]carbamoylamino]benzoate
| Molecular Formula | C17H24N2O5 |
|---|---|
| Molecular Weight | 336.17 g/mol |
| LogP | 2.5725 |
| Topological Polar Surface Area | 93.73 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 336.16852 |
| Heavy Atoms | 24 |
| Complexity | 586.0986 |
Chemical Identifiers
| CAS Number | 1173673-91-0 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=CC=C1)NC(=O)N[C@@H](CC(C)C)C(=O)OC |
Product Overview
methyl N-{[3-(ethoxycarbonyl)phenyl]carbamoyl}-L-leucinate (CAS 1173673-91-0), with molecular formula C17H24N2O5 and molecular weight 336.17 g/mol. IUPAC: ethyl 3-[[(2S)-1-methoxy-4-methyl-1-oxopentan-2-yl]carbamoylamino]benzoate.
Chemical Property Profile of methyl N-{[3-(ethoxycarbonyl)phenyl]carbamoyl}-L-leucinate
Property Insights of methyl N-{[3-(ethoxycarbonyl)phenyl]carbamoyl}-L-leucinate
The XLogP value of 2.5725 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-{[3-(ethoxycarbonyl)phenyl]carbamoyl}-L-leucinate. The TPSA of 93.73 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-{[3-(ethoxycarbonyl)phenyl]carbamoyl}-L-leucinate. Following Lipinski's Rule of Five, methyl N-{[3-(ethoxycarbonyl)phenyl]carbamoyl}-L-leucinate has 2 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 methyl N-{[3-(ethoxycarbonyl)phenyl]carbamoyl}-L-leucinate?
The CAS number of methyl N-{[3-(ethoxycarbonyl)phenyl]carbamoyl}-L-leucinate is 1173673-91-0.
What is the molecular formula of methyl N-{[3-(ethoxycarbonyl)phenyl]carbamoyl}-L-leucinate?
The molecular formula of methyl N-{[3-(ethoxycarbonyl)phenyl]carbamoyl}-L-leucinate is C17H24N2O5.
What is the molecular weight of methyl N-{[3-(ethoxycarbonyl)phenyl]carbamoyl}-L-leucinate?
The molecular weight of methyl N-{[3-(ethoxycarbonyl)phenyl]carbamoyl}-L-leucinate is 336.17 g/mol.
Where can I buy methyl N-{[3-(ethoxycarbonyl)phenyl]carbamoyl}-L-leucinate?
You can request a quote for methyl N-{[3-(ethoxycarbonyl)phenyl]carbamoyl}-L-leucinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl N-{[3-(ethoxycarbonyl)phenyl]carbamoyl}-L-leucinate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-{[3-(ethoxycarbonyl)phenyl]carbamoyl}-L-leucinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.