Tert-butyl N-(benzotriazol-1-ylmethyl)carbamate
TL;DR: Tert-butyl N-(benzotriazol-1-ylmethyl)carbamate (CAS 305860-41-7) 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.
tert-butyl N-(benzotriazol-1-ylmethyl)carbamate
Also Known As: Tert-butyl N-(benzotriazol-1-ylmethyl)carbamate, tert-butyl ((1H-Benzo[d][1,2,3]triazol-1-yl)methyl)carbamate, (R)-4-Benzyl-2-oxazolidinone, 1-(Boc-aminomethyl)-1H-benzo[d][1,2,3]triazole, 1,1-Dimethylethyl N-(1H-benzotriazol-1-ylmethyl)carbamate
| Molecular Formula | C12H16N4O2 |
|---|---|
| Molecular Weight | 248.13 g/mol |
| LogP | 1.9135 |
| Topological Polar Surface Area | 69.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.12732 |
| Heavy Atoms | 18 |
| Complexity | 556.44794 |
Chemical Identifiers
| CAS Number | 305860-41-7 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NCN1C2=CC=CC=C2N=N1 |
Product Overview
Tert-butyl N-(benzotriazol-1-ylmethyl)carbamate (CAS 305860-41-7), with molecular formula C12H16N4O2 and molecular weight 248.13 g/mol. IUPAC: tert-butyl N-(benzotriazol-1-ylmethyl)carbamate.
Chemical Property Profile of Tert-butyl N-(benzotriazol-1-ylmethyl)carbamate
Property Insights of Tert-butyl N-(benzotriazol-1-ylmethyl)carbamate
The XLogP value of 1.9135 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tert-butyl N-(benzotriazol-1-ylmethyl)carbamate. The TPSA of 69.04 Ų falls within the moderate polarity range, balancing permeability and solubility for Tert-butyl N-(benzotriazol-1-ylmethyl)carbamate. Following Lipinski's Rule of Five, Tert-butyl N-(benzotriazol-1-ylmethyl)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 Tert-butyl N-(benzotriazol-1-ylmethyl)carbamate?
The CAS number of Tert-butyl N-(benzotriazol-1-ylmethyl)carbamate is 305860-41-7.
What is the molecular formula of Tert-butyl N-(benzotriazol-1-ylmethyl)carbamate?
The molecular formula of Tert-butyl N-(benzotriazol-1-ylmethyl)carbamate is C12H16N4O2.
What is the molecular weight of Tert-butyl N-(benzotriazol-1-ylmethyl)carbamate?
The molecular weight of Tert-butyl N-(benzotriazol-1-ylmethyl)carbamate is 248.13 g/mol.
Where can I buy Tert-butyl N-(benzotriazol-1-ylmethyl)carbamate?
You can request a quote for Tert-butyl N-(benzotriazol-1-ylmethyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tert-butyl N-(benzotriazol-1-ylmethyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for Tert-butyl N-(benzotriazol-1-ylmethyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.