BAS 00702965
TL;DR: BAS 00702965 (CAS 313971-81-2) is a chemical compound with molecular formula C26H25Cl2NO3 and molecular weight 469.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 4-(2,3-dichlorophenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 00702965, isopropyl 4-(2,3-dichlorophenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, propan-2-yl 4-(2,3-dichlorophenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, propan-2-yl 4-(2,3-dichlorophenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate, methylethyl 4-(2,3-dichlorophenyl)-2-methyl-5-oxo-7-phenyl-1,4,6,7,8-pentahydr oquinoline-3-carboxylate
| Molecular Formula | C26H25Cl2NO3 |
|---|---|
| Molecular Weight | 469.12 g/mol |
| LogP | 6.3066 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 469.12115 |
| Heavy Atoms | 32 |
| Complexity | 1135.0159 |
Chemical Identifiers
| CAS Number | 313971-81-2 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=C(C(=CC=C4)Cl)Cl)C(=O)OC(C)C |
Product Overview
BAS 00702965 (CAS 313971-81-2), with molecular formula C26H25Cl2NO3 and molecular weight 469.12 g/mol. IUPAC: propan-2-yl 4-(2,3-dichlorophenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 00702965
Property Insights of BAS 00702965
The XLogP value of 6.3066 indicates that BAS 00702965 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, BAS 00702965 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00702965 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 00702965?
The CAS number of BAS 00702965 is 313971-81-2.
What is the molecular formula of BAS 00702965?
The molecular formula of BAS 00702965 is C26H25Cl2NO3.
What is the molecular weight of BAS 00702965?
The molecular weight of BAS 00702965 is 469.12 g/mol.
Where can I buy BAS 00702965?
You can request a quote for BAS 00702965 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00702965?
Yes, KEHONG BIO provides custom synthesis services for BAS 00702965 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.