BAS 00410615
TL;DR: BAS 00410615 (CAS 299945-77-0) is a chemical compound with molecular formula C23H26ClNO5 and molecular weight 431.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
prop-2-enyl 4-(3-chloro-4-hydroxy-5-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
Also Known As: BAS 00410615, allyl 4-(3-chloro-4-hydroxy-5-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate, prop-2-en-1-yl 4-(3-chloro-4-hydroxy-5-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, prop-2-enyl 4-(3-chloro-4-hydroxy-5-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate, allyl 4-(3-chloro-4-hydroxy-5-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
| Molecular Formula | C23H26ClNO5 |
|---|---|
| Molecular Weight | 431.15 g/mol |
| LogP | 4.3874 |
| Topological Polar Surface Area | 84.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 431.14996 |
| Heavy Atoms | 30 |
| Complexity | 989.55273 |
Chemical Identifiers
| CAS Number | 299945-77-0 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC(=C(C(=C3)Cl)O)OC)C(=O)OCC=C |
Product Overview
BAS 00410615 (CAS 299945-77-0), with molecular formula C23H26ClNO5 and molecular weight 431.15 g/mol. IUPAC: prop-2-enyl 4-(3-chloro-4-hydroxy-5-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate.
Chemical Property Profile of BAS 00410615
Property Insights of BAS 00410615
The XLogP value of 4.3874 indicates that BAS 00410615 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.86 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00410615. Following Lipinski's Rule of Five, BAS 00410615 has 2 hydrogen bond donor(s) and 6 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 BAS 00410615?
The CAS number of BAS 00410615 is 299945-77-0.
What is the molecular formula of BAS 00410615?
The molecular formula of BAS 00410615 is C23H26ClNO5.
What is the molecular weight of BAS 00410615?
The molecular weight of BAS 00410615 is 431.15 g/mol.
Where can I buy BAS 00410615?
You can request a quote for BAS 00410615 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00410615?
Yes, KEHONG BIO provides custom synthesis services for BAS 00410615 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.