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Methyl N-[(benzyloxy)carbonyl]glycyltryptophanate
TL;DR: Methyl N-[(benzyloxy)carbonyl]glycyltryptophanate (CAS 53880-82-3) is a chemical compound with molecular formula C22H23N3O5 and molecular weight 409.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(1H-indol-3-yl)-2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]propanoate
Also Known As: Methyl N-[(benzyloxy)carbonyl]glycyltryptophanate, methyl (2S)-2-[({[(benzyloxy)carbonyl]amino}acetyl)amino]-3-(1H-indol-3-yl)propanoate, (S)-Methyl 2-(2-(((benzyloxy)carbonyl)amino)acetamido)-3-(1H-indol-3-yl)propanoate, methyl (2S)-2-(2-{[(benzyloxy)carbonyl]amino}acetamido)-3-(1H-indol-3-yl)propanoate, methyl 3-(1H-indol-3-yl)-2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]propanoate
| Molecular Formula | C22H23N3O5 |
|---|---|
| Molecular Weight | 409.16 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 409.16376 |
| Heavy Atoms | 30 |
| Complexity | 593.0 |
Chemical Identifiers
| CAS Number | 53880-82-3 |
|---|---|
| SMILES | COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)CNC(=O)OCC3=CC=CC=C3 |
| InChIKey | LHXVIRURGRILGX-UHFFFAOYSA-N |
Product Overview
Methyl N-[(benzyloxy)carbonyl]glycyltryptophanate (CAS 53880-82-3), with molecular formula C22H23N3O5 and molecular weight 409.16 g/mol. IUPAC: methyl 3-(1H-indol-3-yl)-2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]propanoate.
Chemical Property Profile of Methyl N-[(benzyloxy)carbonyl]glycyltryptophanate
Property Insights of Methyl N-[(benzyloxy)carbonyl]glycyltryptophanate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl N-[(benzyloxy)carbonyl]glycyltryptophanate. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl N-[(benzyloxy)carbonyl]glycyltryptophanate. Following Lipinski's Rule of Five, Methyl N-[(benzyloxy)carbonyl]glycyltryptophanate 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 Methyl N-[(benzyloxy)carbonyl]glycyltryptophanate?
The CAS number of Methyl N-[(benzyloxy)carbonyl]glycyltryptophanate is 53880-82-3.
What is the molecular formula of Methyl N-[(benzyloxy)carbonyl]glycyltryptophanate?
The molecular formula of Methyl N-[(benzyloxy)carbonyl]glycyltryptophanate is C22H23N3O5.
What is the molecular weight of Methyl N-[(benzyloxy)carbonyl]glycyltryptophanate?
The molecular weight of Methyl N-[(benzyloxy)carbonyl]glycyltryptophanate is 409.16 g/mol.
Where can I buy Methyl N-[(benzyloxy)carbonyl]glycyltryptophanate?
You can request a quote for Methyl N-[(benzyloxy)carbonyl]glycyltryptophanate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl N-[(benzyloxy)carbonyl]glycyltryptophanate?
Yes, KEHONG BIO provides custom synthesis services for Methyl N-[(benzyloxy)carbonyl]glycyltryptophanate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.