BAS 00380938
TL;DR: BAS 00380938 (CAS 295344-24-0) is a chemical compound with molecular formula C25H26N2O3 and molecular weight 402.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 2,7,7-trimethyl-5-oxo-4-pyridin-3-yl-1,4,6,8-tetrahydroquinoline-3-carboxylate
Also Known As: BAS 00380938, AB00076534-01, benzyl 2,7,7-trimethyl-5-oxo-4-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, benzyl 2,7,7-trimethyl-5-oxo-4-pyridin-3-yl-1,4,6,8-tetrahydroquinoline-3-carboxylate, Benzyl 2,7,7-trimethyl-5-oxo-4-(3-pyridinyl)-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
| Molecular Formula | C25H26N2O3 |
|---|---|
| Molecular Weight | 402.19 g/mol |
| LogP | 4.429 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 402.19434 |
| Heavy Atoms | 30 |
| Complexity | 1036.5781 |
Chemical Identifiers
| CAS Number | 295344-24-0 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CN=CC=C3)C(=O)OCC4=CC=CC=C4 |
Product Overview
BAS 00380938 (CAS 295344-24-0), with molecular formula C25H26N2O3 and molecular weight 402.19 g/mol. IUPAC: benzyl 2,7,7-trimethyl-5-oxo-4-pyridin-3-yl-1,4,6,8-tetrahydroquinoline-3-carboxylate.
Chemical Property Profile of BAS 00380938
Property Insights of BAS 00380938
The XLogP value of 4.429 indicates that BAS 00380938 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00380938. Following Lipinski's Rule of Five, BAS 00380938 has 1 hydrogen bond donor(s) and 5 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 00380938?
The CAS number of BAS 00380938 is 295344-24-0.
What is the molecular formula of BAS 00380938?
The molecular formula of BAS 00380938 is C25H26N2O3.
What is the molecular weight of BAS 00380938?
The molecular weight of BAS 00380938 is 402.19 g/mol.
Where can I buy BAS 00380938?
You can request a quote for BAS 00380938 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00380938?
Yes, KEHONG BIO provides custom synthesis services for BAS 00380938 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.