BAS 00850245
TL;DR: BAS 00850245 (CAS 354816-17-4) is a chemical compound with molecular formula C20H19ClN2O3 and molecular weight 370.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-chlorophenyl)-8-ethoxy-6-nitro-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
Also Known As: BAS 00850245, 4-(4-chlorophenyl)-8-ethoxy-6-nitro-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline, 4-(4-CHLOROPHENYL)-8-ETHOXY-6-NITRO-3H,3AH,4H,5H,9BH-CYCLOPENTA[C]QUINOLINE
| Molecular Formula | C20H19ClN2O3 |
|---|---|
| Molecular Weight | 370.11 g/mol |
| LogP | 5.4734 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 370.10843 |
| Heavy Atoms | 26 |
| Complexity | 879.3702 |
Chemical Identifiers
| CAS Number | 354816-17-4 |
|---|---|
| SMILES | CCOC1=CC2=C(C(=C1)[N+](=O)[O-])NC(C3C2C=CC3)C4=CC=C(C=C4)Cl |
Product Overview
BAS 00850245 (CAS 354816-17-4), with molecular formula C20H19ClN2O3 and molecular weight 370.11 g/mol. IUPAC: 4-(4-chlorophenyl)-8-ethoxy-6-nitro-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline.
Chemical Property Profile of BAS 00850245
Property Insights of BAS 00850245
The XLogP value of 5.4734 indicates that BAS 00850245 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00850245. Following Lipinski's Rule of Five, BAS 00850245 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00850245?
The CAS number of BAS 00850245 is 354816-17-4.
What is the molecular formula of BAS 00850245?
The molecular formula of BAS 00850245 is C20H19ClN2O3.
What is the molecular weight of BAS 00850245?
The molecular weight of BAS 00850245 is 370.11 g/mol.
Where can I buy BAS 00850245?
You can request a quote for BAS 00850245 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00850245?
Yes, KEHONG BIO provides custom synthesis services for BAS 00850245 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.