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N-[benzotriazol-1-yl(phenyl)methyl]formamide
TL;DR: N-[benzotriazol-1-yl(phenyl)methyl]formamide (CAS 130291-05-3) is a chemical compound with molecular formula C14H12N4O and molecular weight 252.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[benzotriazol-1-yl(phenyl)methyl]formamide
Also Known As: N-[benzotriazol-1-yl(phenyl)methyl]formamide, 1H-1,2,3-benzotriazol-1-yl(phenyl)methylformamide, N-(benzotriazolylphenylmethyl)carboxamide, J1.212.343D, N-[1H-1,2,3-Benzotriazol-1-yl(phenyl)methyl]formamide
| Molecular Formula | C14H12N4O |
|---|---|
| Molecular Weight | 252.10 g/mol |
| LogP | 1.7242 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 252.1011 |
| Heavy Atoms | 19 |
| Complexity | 692.7472 |
Chemical Identifiers
| CAS Number | 130291-05-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(NC=O)N2C3=CC=CC=C3N=N2 |
Product Overview
N-[benzotriazol-1-yl(phenyl)methyl]formamide (CAS 130291-05-3), with molecular formula C14H12N4O and molecular weight 252.10 g/mol. IUPAC: N-[benzotriazol-1-yl(phenyl)methyl]formamide.
Chemical Property Profile of N-[benzotriazol-1-yl(phenyl)methyl]formamide
Property Insights of N-[benzotriazol-1-yl(phenyl)methyl]formamide
The XLogP value of 1.7242 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[benzotriazol-1-yl(phenyl)methyl]formamide. With a topological polar surface area (TPSA) of 59.81 Ų, N-[benzotriazol-1-yl(phenyl)methyl]formamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[benzotriazol-1-yl(phenyl)methyl]formamide has 1 hydrogen bond donor(s) and 3 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-[benzotriazol-1-yl(phenyl)methyl]formamide?
The CAS number of N-[benzotriazol-1-yl(phenyl)methyl]formamide is 130291-05-3.
What is the molecular formula of N-[benzotriazol-1-yl(phenyl)methyl]formamide?
The molecular formula of N-[benzotriazol-1-yl(phenyl)methyl]formamide is C14H12N4O.
What is the molecular weight of N-[benzotriazol-1-yl(phenyl)methyl]formamide?
The molecular weight of N-[benzotriazol-1-yl(phenyl)methyl]formamide is 252.10 g/mol.
Where can I buy N-[benzotriazol-1-yl(phenyl)methyl]formamide?
You can request a quote for N-[benzotriazol-1-yl(phenyl)methyl]formamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[benzotriazol-1-yl(phenyl)methyl]formamide?
Yes, KEHONG BIO provides custom synthesis services for N-[benzotriazol-1-yl(phenyl)methyl]formamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.