BAS 00410635
TL;DR: BAS 00410635 (CAS 299945-87-2) is a chemical compound with molecular formula C23H27Cl2NO3 and molecular weight 435.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 4-(2,3-dichlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
Also Known As: BAS 00410635, butyl 4-(2,3-dichlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, butyl 4-(2,3-dichlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate, butyl 4-(2,3-dichlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate, butyl 4-(2,3-dichlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,7,8-pentahydroquinoli ne-3-carboxylate
| Molecular Formula | C23H27Cl2NO3 |
|---|---|
| Molecular Weight | 435.14 g/mol |
| LogP | 5.9407 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 435.1368 |
| Heavy Atoms | 29 |
| Complexity | 914.69806 |
Chemical Identifiers
| CAS Number | 299945-87-2 |
|---|---|
| SMILES | CCCCOC(=O)C1=C(NC2=C(C1C3=C(C(=CC=C3)Cl)Cl)C(=O)CC(C2)(C)C)C |
Product Overview
BAS 00410635 (CAS 299945-87-2), with molecular formula C23H27Cl2NO3 and molecular weight 435.14 g/mol. IUPAC: butyl 4-(2,3-dichlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate.
Chemical Property Profile of BAS 00410635
Property Insights of BAS 00410635
The XLogP value of 5.9407 indicates that BAS 00410635 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 00410635 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00410635 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 00410635?
The CAS number of BAS 00410635 is 299945-87-2.
What is the molecular formula of BAS 00410635?
The molecular formula of BAS 00410635 is C23H27Cl2NO3.
What is the molecular weight of BAS 00410635?
The molecular weight of BAS 00410635 is 435.14 g/mol.
Where can I buy BAS 00410635?
You can request a quote for BAS 00410635 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00410635?
Yes, KEHONG BIO provides custom synthesis services for BAS 00410635 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.