N-(6-nitro-1,3-benzothiazol-2-yl)-3,3-diphenylpropanamide
TL;DR: N-(6-nitro-1,3-benzothiazol-2-yl)-3,3-diphenylpropanamide (CAS 349133-00-2) is a chemical compound with molecular formula C22H17N3O3S and molecular weight 403.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-nitro-1,3-benzothiazol-2-yl)-3,3-diphenylpropanamide
Also Known As: N-(6-nitro-1,3-benzothiazol-2-yl)-3,3-diphenylpropanamide, N-(6-nitrobenzo[d]thiazol-2-yl)-3,3-diphenylpropanamide, N-(6-nitrobenzothiazol-2-yl)-3,3-diphenylpropanamide, F0537-1224, N-[(2Z)-6-nitro-1,3-benzothiazol-2(3H)-ylidene]-3,3-diphenylpropanamide
| Molecular Formula | C22H17N3O3S |
|---|---|
| Molecular Weight | 403.10 g/mol |
| LogP | 5.3652 |
| Topological Polar Surface Area | 85.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 403.09906 |
| Heavy Atoms | 29 |
| Complexity | 1120.3796 |
Chemical Identifiers
| CAS Number | 349133-00-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(CC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4 |
Product Overview
N-(6-nitro-1,3-benzothiazol-2-yl)-3,3-diphenylpropanamide (CAS 349133-00-2), with molecular formula C22H17N3O3S and molecular weight 403.10 g/mol. IUPAC: N-(6-nitro-1,3-benzothiazol-2-yl)-3,3-diphenylpropanamide.
Chemical Property Profile of N-(6-nitro-1,3-benzothiazol-2-yl)-3,3-diphenylpropanamide
Property Insights of N-(6-nitro-1,3-benzothiazol-2-yl)-3,3-diphenylpropanamide
The XLogP value of 5.3652 indicates that N-(6-nitro-1,3-benzothiazol-2-yl)-3,3-diphenylpropanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.13 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(6-nitro-1,3-benzothiazol-2-yl)-3,3-diphenylpropanamide. Following Lipinski's Rule of Five, N-(6-nitro-1,3-benzothiazol-2-yl)-3,3-diphenylpropanamide 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-(6-nitro-1,3-benzothiazol-2-yl)-3,3-diphenylpropanamide?
The CAS number of N-(6-nitro-1,3-benzothiazol-2-yl)-3,3-diphenylpropanamide is 349133-00-2.
What is the molecular formula of N-(6-nitro-1,3-benzothiazol-2-yl)-3,3-diphenylpropanamide?
The molecular formula of N-(6-nitro-1,3-benzothiazol-2-yl)-3,3-diphenylpropanamide is C22H17N3O3S.
What is the molecular weight of N-(6-nitro-1,3-benzothiazol-2-yl)-3,3-diphenylpropanamide?
The molecular weight of N-(6-nitro-1,3-benzothiazol-2-yl)-3,3-diphenylpropanamide is 403.10 g/mol.
Where can I buy N-(6-nitro-1,3-benzothiazol-2-yl)-3,3-diphenylpropanamide?
You can request a quote for N-(6-nitro-1,3-benzothiazol-2-yl)-3,3-diphenylpropanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(6-nitro-1,3-benzothiazol-2-yl)-3,3-diphenylpropanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(6-nitro-1,3-benzothiazol-2-yl)-3,3-diphenylpropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.