N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-2-phenylquinoline-4-carboxamide
TL;DR: N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-2-phenylquinoline-4-carboxamide (CAS 600136-53-6) is a chemical compound with molecular formula C25H21N3O2S and molecular weight 427.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-2-phenylquinoline-4-carboxamide
Also Known As: N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-2-phenylquinoline-4-carboxamide, N-(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-2-phenylquinoline-4-carboxamide, N-(5,5-dimethyl-7-oxo(4,5,6-trihydrobenzothiazol-2-yl))(2-phenyl(4-quinolyl))c arboxamide, N-(5,5-dimethyl-7-oxo-4,6-dihydrobenzothiazol-2-yl)-2-phenyl-quinoline-4-carboxamide
| Molecular Formula | C25H21N3O2S |
|---|---|
| Molecular Weight | 427.14 g/mol |
| LogP | 5.7657 |
| Topological Polar Surface Area | 71.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 427.13544 |
| Heavy Atoms | 31 |
| Complexity | 1325.3671 |
Chemical Identifiers
| CAS Number | 600136-53-6 |
|---|---|
| SMILES | CC1(CC2=C(C(=O)C1)SC(=N2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5)C |
Product Overview
N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-2-phenylquinoline-4-carboxamide (CAS 600136-53-6), with molecular formula C25H21N3O2S and molecular weight 427.14 g/mol. IUPAC: N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-2-phenylquinoline-4-carboxamide.
Chemical Property Profile of N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-2-phenylquinoline-4-carboxamide
Property Insights of N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-2-phenylquinoline-4-carboxamide
The XLogP value of 5.7657 indicates that N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-2-phenylquinoline-4-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.95 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-2-phenylquinoline-4-carboxamide. Following Lipinski's Rule of Five, N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-2-phenylquinoline-4-carboxamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-2-phenylquinoline-4-carboxamide?
The CAS number of N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-2-phenylquinoline-4-carboxamide is 600136-53-6.
What is the molecular formula of N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-2-phenylquinoline-4-carboxamide?
The molecular formula of N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-2-phenylquinoline-4-carboxamide is C25H21N3O2S.
What is the molecular weight of N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-2-phenylquinoline-4-carboxamide?
The molecular weight of N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-2-phenylquinoline-4-carboxamide is 427.14 g/mol.
Where can I buy N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-2-phenylquinoline-4-carboxamide?
You can request a quote for N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-2-phenylquinoline-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-2-phenylquinoline-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-2-phenylquinoline-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.