BAS 00721978
TL;DR: BAS 00721978 (CAS 331973-80-9) is a chemical compound with molecular formula C25H25ClN2O and molecular weight 404.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-chlorophenyl)-[2,6-dimethyl-4-(4-methylanilino)-3,4-dihydro-2H-quinolin-1-yl]methanone
Also Known As: BAS 00721978, J2.470.639G, (4-chlorophenyl)(2,6-dimethyl-4-(p-tolylamino)-3,4-dihydroquinolin-1(2H)-yl)methanone, (4-chlorophenyl)-[2,6-dimethyl-4-(4-methylanilino)-3,4-dihydro-2H-quinolin-1-yl]methanone, 1-(4-Chlorobenzoyl)-2,6-dimethyl-4-(4-methylphenylamino)-1,2,3,4-tetrahydroquinoline
| Molecular Formula | C25H25ClN2O |
|---|---|
| Molecular Weight | 404.17 g/mol |
| LogP | 6.54904 |
| Topological Polar Surface Area | 32.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 404.16553 |
| Heavy Atoms | 29 |
| Complexity | 1027.694 |
Chemical Identifiers
| CAS Number | 331973-80-9 |
|---|---|
| SMILES | CC1CC(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)C)NC4=CC=C(C=C4)C |
Product Overview
BAS 00721978 (CAS 331973-80-9), with molecular formula C25H25ClN2O and molecular weight 404.17 g/mol. IUPAC: (4-chlorophenyl)-[2,6-dimethyl-4-(4-methylanilino)-3,4-dihydro-2H-quinolin-1-yl]methanone.
Chemical Property Profile of BAS 00721978
Property Insights of BAS 00721978
The XLogP value of 6.54904 indicates that BAS 00721978 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.34 Ų, BAS 00721978 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00721978 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00721978?
The CAS number of BAS 00721978 is 331973-80-9.
What is the molecular formula of BAS 00721978?
The molecular formula of BAS 00721978 is C25H25ClN2O.
What is the molecular weight of BAS 00721978?
The molecular weight of BAS 00721978 is 404.17 g/mol.
Where can I buy BAS 00721978?
You can request a quote for BAS 00721978 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00721978?
Yes, KEHONG BIO provides custom synthesis services for BAS 00721978 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.