(S)-N-(benzo[d]thiazol-2-yl)-3-methyl-2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)butanamide
TL;DR: (S)-N-(benzo[d]thiazol-2-yl)-3-methyl-2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)butanamide (CAS 1173683-17-4) is a chemical compound with molecular formula C19H17N5O2S and molecular weight 379.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-N-(1,3-benzothiazol-2-yl)-3-methyl-2-(4-oxo-1,2,3-benzotriazin-3-yl)butanamide
Also Known As: (S)-N-(benzo[d]thiazol-2-yl)-3-methyl-2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)butanamide, (2S)-N-(1,3-benzothiazol-2-yl)-3-methyl-2-(4-oxo-1,2,3-benzotriazin-3-yl)butanamide, (2S)-N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-3-methyl-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
| Molecular Formula | C19H17N5O2S |
|---|---|
| Molecular Weight | 379.11 g/mol |
| LogP | 3.237 |
| Topological Polar Surface Area | 89.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 379.1103 |
| Heavy Atoms | 27 |
| Complexity | 1164.3779 |
Chemical Identifiers
| CAS Number | 1173683-17-4 |
|---|---|
| SMILES | CC(C)[C@@H](C(=O)NC1=NC2=CC=CC=C2S1)N3C(=O)C4=CC=CC=C4N=N3 |
Product Overview
(S)-N-(benzo[d]thiazol-2-yl)-3-methyl-2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)butanamide (CAS 1173683-17-4), with molecular formula C19H17N5O2S and molecular weight 379.11 g/mol. IUPAC: (2S)-N-(1,3-benzothiazol-2-yl)-3-methyl-2-(4-oxo-1,2,3-benzotriazin-3-yl)butanamide.
Chemical Property Profile of (S)-N-(benzo[d]thiazol-2-yl)-3-methyl-2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)butanamide
Property Insights of (S)-N-(benzo[d]thiazol-2-yl)-3-methyl-2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)butanamide
The XLogP value of 3.237 indicates that (S)-N-(benzo[d]thiazol-2-yl)-3-methyl-2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)butanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.77 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-N-(benzo[d]thiazol-2-yl)-3-methyl-2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)butanamide. Following Lipinski's Rule of Five, (S)-N-(benzo[d]thiazol-2-yl)-3-methyl-2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)butanamide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (S)-N-(benzo[d]thiazol-2-yl)-3-methyl-2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)butanamide?
The CAS number of (S)-N-(benzo[d]thiazol-2-yl)-3-methyl-2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)butanamide is 1173683-17-4.
What is the molecular formula of (S)-N-(benzo[d]thiazol-2-yl)-3-methyl-2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)butanamide?
The molecular formula of (S)-N-(benzo[d]thiazol-2-yl)-3-methyl-2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)butanamide is C19H17N5O2S.
What is the molecular weight of (S)-N-(benzo[d]thiazol-2-yl)-3-methyl-2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)butanamide?
The molecular weight of (S)-N-(benzo[d]thiazol-2-yl)-3-methyl-2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)butanamide is 379.11 g/mol.
Where can I buy (S)-N-(benzo[d]thiazol-2-yl)-3-methyl-2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)butanamide?
You can request a quote for (S)-N-(benzo[d]thiazol-2-yl)-3-methyl-2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-N-(benzo[d]thiazol-2-yl)-3-methyl-2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)butanamide?
Yes, KEHONG BIO provides custom synthesis services for (S)-N-(benzo[d]thiazol-2-yl)-3-methyl-2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.