BAS 00757445
TL;DR: BAS 00757445 (CAS 303018-92-0) is a chemical compound with molecular formula C23H20ClN3O3 and molecular weight 421.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-anilino-2-methyl-3,4-dihydro-2H-quinolin-1-yl)-(4-chloro-3-nitrophenyl)methanone
Also Known As: BAS 00757445, AE-848/11242430, (4-chloro-3-nitrophenyl)(2-methyl-4-(phenylamino)-3,4-dihydroquinolin-1(2H)-yl)methanone, (4-chloro-3-nitrophenyl)[2-methyl-4-(phenylamino)-3,4-dihydroquinolin-1(2H)-yl]methanone, (4-anilino-2-methyl-3,4-dihydro-2H-quinolin-1-yl)-(4-chloro-3-nitrophenyl)methanone
| Molecular Formula | C23H20ClN3O3 |
|---|---|
| Molecular Weight | 421.12 g/mol |
| LogP | 5.8404 |
| Topological Polar Surface Area | 75.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 421.11932 |
| Heavy Atoms | 30 |
| Complexity | 1103.8573 |
Chemical Identifiers
| CAS Number | 303018-92-0 |
|---|---|
| SMILES | CC1CC(C2=CC=CC=C2N1C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])NC4=CC=CC=C4 |
Product Overview
BAS 00757445 (CAS 303018-92-0), with molecular formula C23H20ClN3O3 and molecular weight 421.12 g/mol. IUPAC: (4-anilino-2-methyl-3,4-dihydro-2H-quinolin-1-yl)-(4-chloro-3-nitrophenyl)methanone.
Chemical Property Profile of BAS 00757445
Property Insights of BAS 00757445
The XLogP value of 5.8404 indicates that BAS 00757445 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.48 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00757445. Following Lipinski's Rule of Five, BAS 00757445 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 00757445?
The CAS number of BAS 00757445 is 303018-92-0.
What is the molecular formula of BAS 00757445?
The molecular formula of BAS 00757445 is C23H20ClN3O3.
What is the molecular weight of BAS 00757445?
The molecular weight of BAS 00757445 is 421.12 g/mol.
Where can I buy BAS 00757445?
You can request a quote for BAS 00757445 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00757445?
Yes, KEHONG BIO provides custom synthesis services for BAS 00757445 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.