![methyl N-[1-(benzotriazol-1-yl)-2-methylpropyl]carbamate structure](/static/products/149/149681-89-0.png)
methyl N-[1-(benzotriazol-1-yl)-2-methylpropyl]carbamate
TL;DR: methyl N-[1-(benzotriazol-1-yl)-2-methylpropyl]carbamate (CAS 149681-89-0) is a chemical compound with molecular formula C12H16N4O2 and molecular weight 248.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-[1-(benzotriazol-1-yl)-2-methylpropyl]carbamate
Also Known As: Methyl N-(1-(benzotriazol-1-yl)-2-methylpropyl)carbamate, Methyl N-(1-benzotriazol-1-yl-2-methyl-propyl)carbamate, methyl N-[1-(benzotriazol-1-yl)-2-methylpropyl]carbamate
| Molecular Formula | C12H16N4O2 |
|---|---|
| Molecular Weight | 248.13 g/mol |
| LogP | 1.9419 |
| Topological Polar Surface Area | 69.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 248.12732 |
| Heavy Atoms | 18 |
| Complexity | 549.7559 |
Chemical Identifiers
| CAS Number | 149681-89-0 |
|---|---|
| SMILES | CC(C)C(NC(=O)OC)N1C2=CC=CC=C2N=N1 |
Product Overview
methyl N-[1-(benzotriazol-1-yl)-2-methylpropyl]carbamate (CAS 149681-89-0), with molecular formula C12H16N4O2 and molecular weight 248.13 g/mol. IUPAC: methyl N-[1-(benzotriazol-1-yl)-2-methylpropyl]carbamate.
Chemical Property Profile of methyl N-[1-(benzotriazol-1-yl)-2-methylpropyl]carbamate
Property Insights of methyl N-[1-(benzotriazol-1-yl)-2-methylpropyl]carbamate
The XLogP value of 1.9419 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-[1-(benzotriazol-1-yl)-2-methylpropyl]carbamate. The TPSA of 69.04 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-[1-(benzotriazol-1-yl)-2-methylpropyl]carbamate. Following Lipinski's Rule of Five, methyl N-[1-(benzotriazol-1-yl)-2-methylpropyl]carbamate has 1 hydrogen bond donor(s) and 4 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 methyl N-[1-(benzotriazol-1-yl)-2-methylpropyl]carbamate?
The CAS number of methyl N-[1-(benzotriazol-1-yl)-2-methylpropyl]carbamate is 149681-89-0.
What is the molecular formula of methyl N-[1-(benzotriazol-1-yl)-2-methylpropyl]carbamate?
The molecular formula of methyl N-[1-(benzotriazol-1-yl)-2-methylpropyl]carbamate is C12H16N4O2.
What is the molecular weight of methyl N-[1-(benzotriazol-1-yl)-2-methylpropyl]carbamate?
The molecular weight of methyl N-[1-(benzotriazol-1-yl)-2-methylpropyl]carbamate is 248.13 g/mol.
Where can I buy methyl N-[1-(benzotriazol-1-yl)-2-methylpropyl]carbamate?
You can request a quote for methyl N-[1-(benzotriazol-1-yl)-2-methylpropyl]carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl N-[1-(benzotriazol-1-yl)-2-methylpropyl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-[1-(benzotriazol-1-yl)-2-methylpropyl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.