AB00095032-01
TL;DR: AB00095032-01 (CAS 340177-29-9) is a chemical compound with molecular formula C18H13ClN2O2S2 and molecular weight 388.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[(E)-[3-(3-chlorophenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]phenyl]acetamide
Also Known As: AB00095032-01, A1714/0073068, N-[4-[(E)-[3-(3-chlorophenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]phenyl]acetamide, N-(4-{(E)-[3-(3-chlorophenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenyl)acetamide, N-(4-{[3-(3-chlorophenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenyl)acetamide
| Molecular Formula | C18H13ClN2O2S2 |
|---|---|
| Molecular Weight | 388.01 g/mol |
| LogP | 4.7042 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 388.0107 |
| Heavy Atoms | 25 |
| Complexity | 894.204 |
Chemical Identifiers
| CAS Number | 340177-29-9 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)/C=C/2\C(=O)N(C(=S)S2)C3=CC(=CC=C3)Cl |
Product Overview
AB00095032-01 (CAS 340177-29-9), with molecular formula C18H13ClN2O2S2 and molecular weight 388.01 g/mol. IUPAC: N-[4-[(E)-[3-(3-chlorophenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]phenyl]acetamide.
Chemical Property Profile of AB00095032-01
Property Insights of AB00095032-01
The XLogP value of 4.7042 indicates that AB00095032-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.41 Ų, AB00095032-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00095032-01 has 1 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 AB00095032-01?
The CAS number of AB00095032-01 is 340177-29-9.
What is the molecular formula of AB00095032-01?
The molecular formula of AB00095032-01 is C18H13ClN2O2S2.
What is the molecular weight of AB00095032-01?
The molecular weight of AB00095032-01 is 388.01 g/mol.
Where can I buy AB00095032-01?
You can request a quote for AB00095032-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00095032-01?
Yes, KEHONG BIO provides custom synthesis services for AB00095032-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.