![N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamothioyl]-3-methylbutanamide structure](/static/products/4296/429654-92-2.webp)
N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamothioyl]-3-methylbutanamide
TL;DR: N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamothioyl]-3-methylbutanamide (CAS 429654-92-2) is a chemical compound with molecular formula C19H21N5O2S and molecular weight 383.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamothioyl]-3-methylbutanamide
Also Known As: N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamothioyl]-3-methylbutanamide, N-{[2-(4-methoxyphenyl)-2H-benzotriazol-5-yl]carbamothioyl}-3-methylbutanamide
| Molecular Formula | C19H21N5O2S |
|---|---|
| Molecular Weight | 383.14 g/mol |
| LogP | 3.2882 |
| Topological Polar Surface Area | 81.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 383.1416 |
| Heavy Atoms | 27 |
| Complexity | 965.8954 |
Chemical Identifiers
| CAS Number | 429654-92-2 |
|---|---|
| SMILES | CC(C)CC(=O)NC(=S)NC1=CC2=NN(N=C2C=C1)C3=CC=C(C=C3)OC |
Product Overview
N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamothioyl]-3-methylbutanamide (CAS 429654-92-2), with molecular formula C19H21N5O2S and molecular weight 383.14 g/mol. IUPAC: N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamothioyl]-3-methylbutanamide.
Chemical Property Profile of N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamothioyl]-3-methylbutanamide
Property Insights of N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamothioyl]-3-methylbutanamide
The XLogP value of 3.2882 indicates that N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamothioyl]-3-methylbutanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.07 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamothioyl]-3-methylbutanamide. Following Lipinski's Rule of Five, N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamothioyl]-3-methylbutanamide has 2 hydrogen bond donor(s) and 5 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 N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamothioyl]-3-methylbutanamide?
The CAS number of N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamothioyl]-3-methylbutanamide is 429654-92-2.
What is the molecular formula of N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamothioyl]-3-methylbutanamide?
The molecular formula of N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamothioyl]-3-methylbutanamide is C19H21N5O2S.
What is the molecular weight of N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamothioyl]-3-methylbutanamide?
The molecular weight of N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamothioyl]-3-methylbutanamide is 383.14 g/mol.
Where can I buy N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamothioyl]-3-methylbutanamide?
You can request a quote for N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamothioyl]-3-methylbutanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamothioyl]-3-methylbutanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamothioyl]-3-methylbutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.