![N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-methylbenzamide structure](/static/products/4284/428446-38-2.webp)
N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-methylbenzamide
TL;DR: N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-methylbenzamide (CAS 428446-38-2) is a chemical compound with molecular formula C22H17N3OS2 and molecular weight 403.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-methylbenzamide
Also Known As: AM-879/40777389, N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-methylbenzamide, N-{[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl}-4-methylbenzamide, N-[4-(1,3-benzothiazol-2-yl)phenyl]-N'-(4-methylbenzoyl)thiourea
| Molecular Formula | C22H17N3OS2 |
|---|---|
| Molecular Weight | 403.08 g/mol |
| LogP | 5.39852 |
| Topological Polar Surface Area | 54.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 403.0813 |
| Heavy Atoms | 28 |
| Complexity | 1115.6041 |
Chemical Identifiers
| CAS Number | 428446-38-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4S3 |
Product Overview
N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-methylbenzamide (CAS 428446-38-2), with molecular formula C22H17N3OS2 and molecular weight 403.08 g/mol. IUPAC: N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-methylbenzamide.
Chemical Property Profile of N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-methylbenzamide
Property Insights of N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-methylbenzamide
The XLogP value of 5.39852 indicates that N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-methylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.02 Ų, N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-methylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-methylbenzamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-methylbenzamide?
The CAS number of N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-methylbenzamide is 428446-38-2.
What is the molecular formula of N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-methylbenzamide?
The molecular formula of N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-methylbenzamide is C22H17N3OS2.
What is the molecular weight of N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-methylbenzamide?
The molecular weight of N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-methylbenzamide is 403.08 g/mol.
Where can I buy N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-methylbenzamide?
You can request a quote for N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-methylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.