RefChem:823364
TL;DR: RefChem:823364 (CAS 445015-07-6) is a chemical compound with molecular formula C26H24FN3O2S and molecular weight 461.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzothiazol-2-yl)-4-(3-fluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxamide
Also Known As: N-(1,3-benzothiazol-2-yl)-4-(3-fluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxamide, N-(1,3-benzothiazol-2-yl)-4-(3-fluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxamide, N-(Benzo[d]thiazol-2-yl)-4-(3-fluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide, 648-348-8, N-(1,3-benzothiazol-2-yl)-4-(3-fluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
| Molecular Formula | C26H24FN3O2S |
|---|---|
| Molecular Weight | 461.16 g/mol |
| LogP | 5.6781 |
| Topological Polar Surface Area | 71.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 461.15732 |
| Heavy Atoms | 33 |
| Complexity | 1335.6239 |
Chemical Identifiers
| CAS Number | 445015-07-6 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC(=CC=C3)F)C(=O)NC4=NC5=CC=CC=C5S4 |
Product Overview
RefChem:823364 (CAS 445015-07-6), with molecular formula C26H24FN3O2S and molecular weight 461.16 g/mol. IUPAC: N-(1,3-benzothiazol-2-yl)-4-(3-fluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxamide.
Chemical Property Profile of RefChem:823364
Property Insights of RefChem:823364
The XLogP value of 5.6781 indicates that RefChem:823364 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.09 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:823364. Following Lipinski's Rule of Five, RefChem:823364 has 2 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 RefChem:823364?
The CAS number of RefChem:823364 is 445015-07-6.
What is the molecular formula of RefChem:823364?
The molecular formula of RefChem:823364 is C26H24FN3O2S.
What is the molecular weight of RefChem:823364?
The molecular weight of RefChem:823364 is 461.16 g/mol.
Where can I buy RefChem:823364?
You can request a quote for RefChem:823364 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:823364?
Yes, KEHONG BIO provides custom synthesis services for RefChem:823364 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.