BAS 00380897
TL;DR: BAS 00380897 (CAS 295343-87-2) is a chemical compound with molecular formula C24H30N2O5 and molecular weight 426.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentyl 2,7,7-trimethyl-4-(2-nitrophenyl)-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
Also Known As: BAS 00380897, pentyl 2,7,7-trimethyl-4-(2-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, VU0087039-2, F0265-0174, pentyl 2,7,7-trimethyl-4-(2-nitrophenyl)-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
| Molecular Formula | C24H30N2O5 |
|---|---|
| Molecular Weight | 426.22 g/mol |
| LogP | 4.9322 |
| Topological Polar Surface Area | 98.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 426.21548 |
| Heavy Atoms | 31 |
| Complexity | 973.9367 |
Chemical Identifiers
| CAS Number | 295343-87-2 |
|---|---|
| SMILES | CCCCCOC(=O)C1=C(NC2=C(C1C3=CC=CC=C3[N+](=O)[O-])C(=O)CC(C2)(C)C)C |
Product Overview
BAS 00380897 (CAS 295343-87-2), with molecular formula C24H30N2O5 and molecular weight 426.22 g/mol. IUPAC: pentyl 2,7,7-trimethyl-4-(2-nitrophenyl)-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate.
Chemical Property Profile of BAS 00380897
Property Insights of BAS 00380897
The XLogP value of 4.9322 indicates that BAS 00380897 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.54 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00380897. Following Lipinski's Rule of Five, BAS 00380897 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 00380897?
The CAS number of BAS 00380897 is 295343-87-2.
What is the molecular formula of BAS 00380897?
The molecular formula of BAS 00380897 is C24H30N2O5.
What is the molecular weight of BAS 00380897?
The molecular weight of BAS 00380897 is 426.22 g/mol.
Where can I buy BAS 00380897?
You can request a quote for BAS 00380897 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00380897?
Yes, KEHONG BIO provides custom synthesis services for BAS 00380897 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.