Bionet1_004682
TL;DR: Bionet1_004682 (CAS 691880-97-4) is a chemical compound with molecular formula C15H18N2O4S2 and molecular weight 354.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-2-(phenylmethoxycarbonylamino)propanoate
Also Known As: Bionet1_004682, methyl 2-{[(benzyloxy)carbonyl]amino}-3-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)propanoate, 2R-0015, methyl 3-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-2-(phenylmethoxycarbonylamino)propanoate, methyl2-{[(benzyloxy)carbonyl]amino}-3-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)propanoate
| Molecular Formula | C15H18N2O4S2 |
|---|---|
| Molecular Weight | 354.07 g/mol |
| LogP | 2.2904 |
| Topological Polar Surface Area | 76.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 354.0708 |
| Heavy Atoms | 23 |
| Complexity | 565.8551 |
Chemical Identifiers
| CAS Number | 691880-97-4 |
|---|---|
| SMILES | COC(=O)C(CSC1=NCCS1)NC(=O)OCC2=CC=CC=C2 |
Product Overview
Bionet1_004682 (CAS 691880-97-4), with molecular formula C15H18N2O4S2 and molecular weight 354.07 g/mol. IUPAC: methyl 3-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-2-(phenylmethoxycarbonylamino)propanoate.
Chemical Property Profile of Bionet1_004682
Property Insights of Bionet1_004682
The XLogP value of 2.2904 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bionet1_004682. The TPSA of 76.99 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_004682. Following Lipinski's Rule of Five, Bionet1_004682 has 1 hydrogen bond donor(s) and 7 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 Bionet1_004682?
The CAS number of Bionet1_004682 is 691880-97-4.
What is the molecular formula of Bionet1_004682?
The molecular formula of Bionet1_004682 is C15H18N2O4S2.
What is the molecular weight of Bionet1_004682?
The molecular weight of Bionet1_004682 is 354.07 g/mol.
Where can I buy Bionet1_004682?
You can request a quote for Bionet1_004682 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_004682?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_004682 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.