BAS 00850276
TL;DR: BAS 00850276 (CAS 485389-27-3) is a chemical compound with molecular formula C24H19Cl2FN2O2S and molecular weight 488.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,6-dichloro-4-(4-fluorophenyl)-2-(2-nitrophenyl)sulfanyl-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline
Also Known As: BAS 00850276, 1,6-dichloro-4-(4-fluorophenyl)-2-({2-nitrophenyl}sulfanyl)-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline, 1,6-dichloro-4-(4-fluorophenyl)-2-(2-nitrophenyl)sulfanyl-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline
| Molecular Formula | C24H19Cl2FN2O2S |
|---|---|
| Molecular Weight | 488.05 g/mol |
| LogP | 7.4259 |
| Topological Polar Surface Area | 55.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 488.05283 |
| Heavy Atoms | 32 |
| Complexity | 1176.9158 |
Chemical Identifiers
| CAS Number | 485389-27-3 |
|---|---|
| SMILES | C1C2C(C(C1SC3=CC=CC=C3[N+](=O)[O-])Cl)C4=C(C(=CC=C4)Cl)NC2C5=CC=C(C=C5)F |
Product Overview
BAS 00850276 (CAS 485389-27-3), with molecular formula C24H19Cl2FN2O2S and molecular weight 488.05 g/mol. IUPAC: 1,6-dichloro-4-(4-fluorophenyl)-2-(2-nitrophenyl)sulfanyl-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline.
Chemical Property Profile of BAS 00850276
Property Insights of BAS 00850276
The XLogP value of 7.4259 indicates that BAS 00850276 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.17 Ų, BAS 00850276 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00850276 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00850276?
The CAS number of BAS 00850276 is 485389-27-3.
What is the molecular formula of BAS 00850276?
The molecular formula of BAS 00850276 is C24H19Cl2FN2O2S.
What is the molecular weight of BAS 00850276?
The molecular weight of BAS 00850276 is 488.05 g/mol.
Where can I buy BAS 00850276?
You can request a quote for BAS 00850276 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00850276?
Yes, KEHONG BIO provides custom synthesis services for BAS 00850276 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.