AB00671799-01
TL;DR: AB00671799-01 (CAS 887897-72-5) is a chemical compound with molecular formula C20H20ClN3OS and molecular weight 385.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chlorophenyl)-3-[2-(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]thiourea
Also Known As: AB00671799-01, F0667-0190, 1-(2-chlorophenyl)-3-(2-(7,8-dimethyl-2-oxo-1,2-dihydroquinolin-3-yl)ethyl)thiourea, 1-(2-chlorophenyl)-3-[2-(7,8-dimethyl-2-oxo-1,2-dihydroquinolin-3-yl)ethyl]thiourea, 1-(2-chlorophenyl)-3-[2-(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]thiourea
| Molecular Formula | C20H20ClN3OS |
|---|---|
| Molecular Weight | 385.10 g/mol |
| LogP | 4.32744 |
| Topological Polar Surface Area | 56.92 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 385.10156 |
| Heavy Atoms | 26 |
| Complexity | 1029.2303 |
Chemical Identifiers
| CAS Number | 887897-72-5 |
|---|---|
| SMILES | CC1=C(C2=C(C=C1)C=C(C(=O)N2)CCNC(=S)NC3=CC=CC=C3Cl)C |
Product Overview
AB00671799-01 (CAS 887897-72-5), with molecular formula C20H20ClN3OS and molecular weight 385.10 g/mol. IUPAC: 1-(2-chlorophenyl)-3-[2-(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]thiourea.
Chemical Property Profile of AB00671799-01
Property Insights of AB00671799-01
The XLogP value of 4.32744 indicates that AB00671799-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.92 Ų, AB00671799-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00671799-01 has 3 hydrogen bond donor(s) and 2 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 AB00671799-01?
The CAS number of AB00671799-01 is 887897-72-5.
What is the molecular formula of AB00671799-01?
The molecular formula of AB00671799-01 is C20H20ClN3OS.
What is the molecular weight of AB00671799-01?
The molecular weight of AB00671799-01 is 385.10 g/mol.
Where can I buy AB00671799-01?
You can request a quote for AB00671799-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00671799-01?
Yes, KEHONG BIO provides custom synthesis services for AB00671799-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.