N,N-dimethylbenzotriazole-1-carboxamide
TL;DR: N,N-dimethylbenzotriazole-1-carboxamide (CAS 56533-01-8) is a chemical compound with molecular formula C9H10N4O and molecular weight 190.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethylbenzotriazole-1-carboxamide
Also Known As: N,N-dimethylbenzotriazole-1-carboxamide, benzotriazolyl-N,N-dimethylcarboxamide, SDCCGSBI-0660497.P001, N,N-dimethyl-1H-1,2,3-benzotriazole-1-carboxamide, F1021-1039
| Molecular Formula | C9H10N4O |
|---|---|
| Molecular Weight | 190.09 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 51.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 190.08546 |
| Heavy Atoms | 14 |
| Complexity | 231.0 |
Chemical Identifiers
| CAS Number | 56533-01-8 |
|---|---|
| SMILES | CN(C)C(=O)N1C2=CC=CC=C2N=N1 |
| InChIKey | SZDIPSOWTZADHA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N-dimethylbenzotriazole-1-carboxamide (CAS 56533-01-8), with molecular formula C9H10N4O and molecular weight 190.09 g/mol. IUPAC: N,N-dimethylbenzotriazole-1-carboxamide.
Chemical Property Profile of N,N-dimethylbenzotriazole-1-carboxamide
Property Insights of N,N-dimethylbenzotriazole-1-carboxamide
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-dimethylbenzotriazole-1-carboxamide. With a topological polar surface area (TPSA) of 51.0 Ų, N,N-dimethylbenzotriazole-1-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-dimethylbenzotriazole-1-carboxamide has 0 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,N-dimethylbenzotriazole-1-carboxamide?
The CAS number of N,N-dimethylbenzotriazole-1-carboxamide is 56533-01-8.
What is the molecular formula of N,N-dimethylbenzotriazole-1-carboxamide?
The molecular formula of N,N-dimethylbenzotriazole-1-carboxamide is C9H10N4O.
What is the molecular weight of N,N-dimethylbenzotriazole-1-carboxamide?
The molecular weight of N,N-dimethylbenzotriazole-1-carboxamide is 190.09 g/mol.
Where can I buy N,N-dimethylbenzotriazole-1-carboxamide?
You can request a quote for N,N-dimethylbenzotriazole-1-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-dimethylbenzotriazole-1-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N,N-dimethylbenzotriazole-1-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.