BAS 00916000
TL;DR: BAS 00916000 (CAS 330674-67-4) is a chemical compound with molecular formula C33H33NO5 and molecular weight 523.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenylethyl 4-(3-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 00916000, 2-phenylethyl 4-(3-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, 2-phenylethyl 4-(3-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate, 2-PHENYLETHYL 4-(3-ETHOXY-4-HYDROXYPHENYL)-2-METHYL-5-OXO-7-PHENYL-4,6,7,8-TETRAHYDRO-1H-QUINOLINE-3-CARBOXYLATE, 2-phenylethyl 4-(3-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-7-phenyl-1,4,6,7,8-p entahydroquinoline-3-carboxylate
| Molecular Formula | C33H33NO5 |
|---|---|
| Molecular Weight | 523.24 g/mol |
| LogP | 5.9384 |
| Topological Polar Surface Area | 84.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 523.2359 |
| Heavy Atoms | 39 |
| Complexity | 1424.9631 |
Chemical Identifiers
| CAS Number | 330674-67-4 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)C2C3=C(CC(CC3=O)C4=CC=CC=C4)NC(=C2C(=O)OCCC5=CC=CC=C5)C)O |
Product Overview
BAS 00916000 (CAS 330674-67-4), with molecular formula C33H33NO5 and molecular weight 523.24 g/mol. IUPAC: 2-phenylethyl 4-(3-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 00916000
Property Insights of BAS 00916000
The XLogP value of 5.9384 indicates that BAS 00916000 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 00916000. Following Lipinski's Rule of Five, BAS 00916000 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00916000?
The CAS number of BAS 00916000 is 330674-67-4.
What is the molecular formula of BAS 00916000?
The molecular formula of BAS 00916000 is C33H33NO5.
What is the molecular weight of BAS 00916000?
The molecular weight of BAS 00916000 is 523.24 g/mol.
Where can I buy BAS 00916000?
You can request a quote for BAS 00916000 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00916000?
Yes, KEHONG BIO provides custom synthesis services for BAS 00916000 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.