A3782/0160525
TL;DR: A3782/0160525 (CAS 727680-38-8) is a chemical compound with molecular formula C24H21F3N4O2S and molecular weight 486.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-benzothiazol-2-ylamino)-6,6-dimethyl-1-(pyridin-3-ylmethyl)-3-(trifluoromethyl)-5,7-dihydroindole-2,4-dione
Also Known As: A3782/0160525, 3-(1,3-benzothiazol-2(3H)-ylideneamino)-6,6-dimethyl-1-(pyridin-3-ylmethyl)-3-(trifluoromethyl)-3,5,6,7-tetrahydro-1H-indole-2,4-dione, 3-(1,3-benzothiazol-2-ylamino)-6,6-dimethyl-1-(pyridin-3-ylmethyl)-3-(trifluoromethyl)-3,5,6,7-tetrahydro-1H-indole-2,4-dione, 3-(1,3-benzothiazol-2-ylamino)-6,6-dimethyl-1-(pyridin-3-ylmethyl)-3-(trifluoromethyl)-5,7-dihydroindole-2,4-dione, 3-(1,3-benzothiazol-2-ylamino)-6,6-dimethyl-1-(pyridin-3-ylmethyl)-3-trifluoromethyl-3,5,6,7-tetra-hydro-1h-indole-2,4-dione
| Molecular Formula | C24H21F3N4O2S |
|---|---|
| Molecular Weight | 486.13 g/mol |
| LogP | 5.0899 |
| Topological Polar Surface Area | 75.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 486.13373 |
| Heavy Atoms | 34 |
| Complexity | 1299.7416 |
Chemical Identifiers
| CAS Number | 727680-38-8 |
|---|---|
| SMILES | CC1(CC2=C(C(=O)C1)C(C(=O)N2CC3=CN=CC=C3)(C(F)(F)F)NC4=NC5=CC=CC=C5S4)C |
Product Overview
A3782/0160525 (CAS 727680-38-8), with molecular formula C24H21F3N4O2S and molecular weight 486.13 g/mol. IUPAC: 3-(1,3-benzothiazol-2-ylamino)-6,6-dimethyl-1-(pyridin-3-ylmethyl)-3-(trifluoromethyl)-5,7-dihydroindole-2,4-dione.
Chemical Property Profile of A3782/0160525
Property Insights of A3782/0160525
The XLogP value of 5.0899 indicates that A3782/0160525 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.19 Ų falls within the moderate polarity range, balancing permeability and solubility for A3782/0160525. Following Lipinski's Rule of Five, A3782/0160525 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A3782/0160525?
The CAS number of A3782/0160525 is 727680-38-8.
What is the molecular formula of A3782/0160525?
The molecular formula of A3782/0160525 is C24H21F3N4O2S.
What is the molecular weight of A3782/0160525?
The molecular weight of A3782/0160525 is 486.13 g/mol.
Where can I buy A3782/0160525?
You can request a quote for A3782/0160525 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3782/0160525?
Yes, KEHONG BIO provides custom synthesis services for A3782/0160525 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.