N-(benzotriazol-1-ylmethyl)propanamide
TL;DR: N-(benzotriazol-1-ylmethyl)propanamide (CAS 164299-68-7) is a chemical compound with molecular formula C10H12N4O and molecular weight 204.1011 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(benzotriazol-1-ylmethyl)propanamide
Also Known As: starbld0037983, N-(benzotriazol-1-ylmethyl)propanamide, N-(1H-1,2,3-Benzotriazol-1-ylmethyl)propanamide, N-((1H-Benzo[d][1,2,3]triazol-1-yl)methyl)propionamide, N-[(1H-1,2,3-benzotriazol-1-yl)methyl]propanamide
Technical Specifications
| Molecular Formula | C10H12N4O |
| Molecular Weight | 204.1011 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 59.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 204.1011 Da |
| Heavy Atoms | 15 |
| Complexity | 233.0 |
| SMILES | CCC(=O)NCN1C2=CC=CC=C2N=N1 |
| InChIKey | UBUNOJSHGONUTB-UHFFFAOYSA-N |
Chemical Property Profile of N-(benzotriazol-1-ylmethyl)propanamide
Property Insights of N-(benzotriazol-1-ylmethyl)propanamide
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(benzotriazol-1-ylmethyl)propanamide. With a topological polar surface area (TPSA) of 59.8 Ų, N-(benzotriazol-1-ylmethyl)propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(benzotriazol-1-ylmethyl)propanamide 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
What is the CAS number of N-(benzotriazol-1-ylmethyl)propanamide?
The CAS number of N-(benzotriazol-1-ylmethyl)propanamide is 164299-68-7.
What is the molecular formula of N-(benzotriazol-1-ylmethyl)propanamide?
The molecular formula of N-(benzotriazol-1-ylmethyl)propanamide is C10H12N4O.
What is the molecular weight of N-(benzotriazol-1-ylmethyl)propanamide?
The molecular weight of N-(benzotriazol-1-ylmethyl)propanamide is 204.1011 g/mol.
Where can I buy N-(benzotriazol-1-ylmethyl)propanamide?
You can request a quote for N-(benzotriazol-1-ylmethyl)propanamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(benzotriazol-1-ylmethyl)propanamide?
Yes, CoreyChem provides custom synthesis services for N-(benzotriazol-1-ylmethyl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.