BAS 00410996
TL;DR: BAS 00410996 (CAS 299947-63-0) is a chemical compound with molecular formula C28H29NO5 and molecular weight 459.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
prop-2-enyl 4-(3-methoxy-4-phenylmethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 00410996, prop-2-en-1-yl 4-[4-(benzyloxy)-3-methoxyphenyl]-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, prop-2-enyl 2-methyl-4-{3-(methyloxy)-4-[(phenylmethyl)oxy]phenyl}-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, prop-2-enyl 4-(3-methoxy-4-phenylmethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate, allyl 4-(4-(benzyloxy)-3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
| Molecular Formula | C28H29NO5 |
|---|---|
| Molecular Weight | 459.20 g/mol |
| LogP | 4.9713 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 459.20456 |
| Heavy Atoms | 34 |
| Complexity | 1162.5739 |
Chemical Identifiers
| CAS Number | 299947-63-0 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)C(=O)OCC=C |
Product Overview
BAS 00410996 (CAS 299947-63-0), with molecular formula C28H29NO5 and molecular weight 459.20 g/mol. IUPAC: prop-2-enyl 4-(3-methoxy-4-phenylmethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 00410996
Property Insights of BAS 00410996
The XLogP value of 4.9713 indicates that BAS 00410996 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.86 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00410996. Following Lipinski's Rule of Five, BAS 00410996 has 1 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 00410996?
The CAS number of BAS 00410996 is 299947-63-0.
What is the molecular formula of BAS 00410996?
The molecular formula of BAS 00410996 is C28H29NO5.
What is the molecular weight of BAS 00410996?
The molecular weight of BAS 00410996 is 459.20 g/mol.
Where can I buy BAS 00410996?
You can request a quote for BAS 00410996 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00410996?
Yes, KEHONG BIO provides custom synthesis services for BAS 00410996 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.