BAS 00679742
TL;DR: BAS 00679742 (CAS 327043-19-6) is a chemical compound with molecular formula C30H33NO3 and molecular weight 455.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclohexyl 2-methyl-4-(4-methylphenyl)-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 00679742, cyclohexyl 2-methyl-4-(4-methylphenyl)-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, cyclohexyl 2-methyl-4-(4-methylphenyl)-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate, cyclohexyl 2-methyl-4-(4-methylphenyl)-5-oxo-7-phenyl-1,4,6,7,8-pentahydroquin oline-3-carboxylate, cyclohexyl 2-methyl-5-oxo-7-phenyl-4-(p-tolyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
| Molecular Formula | C30H33NO3 |
|---|---|
| Molecular Weight | 455.25 g/mol |
| LogP | 6.23252 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 455.24603 |
| Heavy Atoms | 34 |
| Complexity | 1137.3328 |
Chemical Identifiers
| CAS Number | 327043-19-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2C3=C(CC(CC3=O)C4=CC=CC=C4)NC(=C2C(=O)OC5CCCCC5)C |
Product Overview
BAS 00679742 (CAS 327043-19-6), with molecular formula C30H33NO3 and molecular weight 455.25 g/mol. IUPAC: cyclohexyl 2-methyl-4-(4-methylphenyl)-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 00679742
Property Insights of BAS 00679742
The XLogP value of 6.23252 indicates that BAS 00679742 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 00679742 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00679742 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 00679742?
The CAS number of BAS 00679742 is 327043-19-6.
What is the molecular formula of BAS 00679742?
The molecular formula of BAS 00679742 is C30H33NO3.
What is the molecular weight of BAS 00679742?
The molecular weight of BAS 00679742 is 455.25 g/mol.
Where can I buy BAS 00679742?
You can request a quote for BAS 00679742 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00679742?
Yes, KEHONG BIO provides custom synthesis services for BAS 00679742 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.