(3-Benzyloxycarbonylaminopropionylamino)acetic acid, benzyl ester
TL;DR: (3-Benzyloxycarbonylaminopropionylamino)acetic acid, benzyl ester (CAS 30593-19-2) is a chemical compound with molecular formula C20H22N2O5 and molecular weight 370.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 2-[3-(phenylmethoxycarbonylamino)propanoylamino]acetate
Also Known As: benzyl 2-[3-(phenylmethoxycarbonylamino)propanoylamino]acetate, (3-Benzyloxycarbonylaminopropionylamino)acetic acid, benzyl ester, Benzyl N-[(benzyloxy)carbonyl]-beta-alanylglycinate, benzyl 2-(3-{[(benzyloxy)carbonyl]amino}propanamido)acetate, 1,13b-Dihydro-3-phenyl-4H-as-triazino<4,3-f>phenanthridin
| Molecular Formula | C20H22N2O5 |
|---|---|
| Molecular Weight | 370.15 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 93.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 370.15286 |
| Heavy Atoms | 27 |
| Complexity | 471.0 |
Chemical Identifiers
| CAS Number | 30593-19-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)CNC(=O)CCNC(=O)OCC2=CC=CC=C2 |
| InChIKey | MPBXFSOLQZVNGH-UHFFFAOYSA-N |
Product Overview
(3-Benzyloxycarbonylaminopropionylamino)acetic acid, benzyl ester (CAS 30593-19-2), with molecular formula C20H22N2O5 and molecular weight 370.15 g/mol. IUPAC: benzyl 2-[3-(phenylmethoxycarbonylamino)propanoylamino]acetate.
Chemical Property Profile of (3-Benzyloxycarbonylaminopropionylamino)acetic acid, benzyl ester
Property Insights of (3-Benzyloxycarbonylaminopropionylamino)acetic acid, benzyl ester
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3-Benzyloxycarbonylaminopropionylamino)acetic acid, benzyl ester. The TPSA of 93.7 Ų falls within the moderate polarity range, balancing permeability and solubility for (3-Benzyloxycarbonylaminopropionylamino)acetic acid, benzyl ester. Following Lipinski's Rule of Five, (3-Benzyloxycarbonylaminopropionylamino)acetic acid, benzyl ester 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 (3-Benzyloxycarbonylaminopropionylamino)acetic acid, benzyl ester?
The CAS number of (3-Benzyloxycarbonylaminopropionylamino)acetic acid, benzyl ester is 30593-19-2.
What is the molecular formula of (3-Benzyloxycarbonylaminopropionylamino)acetic acid, benzyl ester?
The molecular formula of (3-Benzyloxycarbonylaminopropionylamino)acetic acid, benzyl ester is C20H22N2O5.
What is the molecular weight of (3-Benzyloxycarbonylaminopropionylamino)acetic acid, benzyl ester?
The molecular weight of (3-Benzyloxycarbonylaminopropionylamino)acetic acid, benzyl ester is 370.15 g/mol.
Where can I buy (3-Benzyloxycarbonylaminopropionylamino)acetic acid, benzyl ester?
You can request a quote for (3-Benzyloxycarbonylaminopropionylamino)acetic acid, benzyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Benzyloxycarbonylaminopropionylamino)acetic acid, benzyl ester?
Yes, KEHONG BIO provides custom synthesis services for (3-Benzyloxycarbonylaminopropionylamino)acetic acid, benzyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.