Hydrazinecarboxylic acid, 2-(2H-1,4-benzoxazin-3-yl)-, 1,1-dimethylethyl ester
TL;DR: Hydrazinecarboxylic acid, 2-(2H-1,4-benzoxazin-3-yl)-, 1,1-dimethylethyl ester (CAS 78959-40-7) is a chemical compound with molecular formula C13H17N3O3 and molecular weight 263.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-(2H-1,4-benzoxazin-3-ylamino)carbamate
Also Known As: tert-butyl N-(2H-1,4-benzoxazin-3-ylamino)carbamate, Hydrazinecarboxylic acid, 2-(2H-1,4-benzoxazin-3-yl)-, 1,1-dimethylethyl ester, 1,1-Dimethylethyl 2-(2H-1,4-benzoxazin-3-yl)hydrazinecarboxylate, tert-Butyl 2-(2H-1,4-benzoxazin-3-yl)hydrazine-1-carboxylate, TERT-BUTYL N-(10-OXA-7-AZABICYCLO[4.4.0]DECA-1,3,5,7-TETRAEN-8-YLAMINO)CARBAMATE
| Molecular Formula | C13H17N3O3 |
|---|---|
| Molecular Weight | 263.13 g/mol |
| LogP | 2.1383 |
| Topological Polar Surface Area | 71.95 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 263.12698 |
| Heavy Atoms | 19 |
| Complexity | 506.10007 |
Chemical Identifiers
| CAS Number | 78959-40-7 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NNC1=NC2=CC=CC=C2OC1 |
Product Overview
Hydrazinecarboxylic acid, 2-(2H-1,4-benzoxazin-3-yl)-, 1,1-dimethylethyl ester (CAS 78959-40-7), with molecular formula C13H17N3O3 and molecular weight 263.13 g/mol. IUPAC: tert-butyl N-(2H-1,4-benzoxazin-3-ylamino)carbamate.
Chemical Property Profile of Hydrazinecarboxylic acid, 2-(2H-1,4-benzoxazin-3-yl)-, 1,1-dimethylethyl ester
Property Insights of Hydrazinecarboxylic acid, 2-(2H-1,4-benzoxazin-3-yl)-, 1,1-dimethylethyl ester
The XLogP value of 2.1383 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hydrazinecarboxylic acid, 2-(2H-1,4-benzoxazin-3-yl)-, 1,1-dimethylethyl ester. The TPSA of 71.95 Ų falls within the moderate polarity range, balancing permeability and solubility for Hydrazinecarboxylic acid, 2-(2H-1,4-benzoxazin-3-yl)-, 1,1-dimethylethyl ester. Following Lipinski's Rule of Five, Hydrazinecarboxylic acid, 2-(2H-1,4-benzoxazin-3-yl)-, 1,1-dimethylethyl ester has 2 hydrogen bond donor(s) and 5 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 Hydrazinecarboxylic acid, 2-(2H-1,4-benzoxazin-3-yl)-, 1,1-dimethylethyl ester?
The CAS number of Hydrazinecarboxylic acid, 2-(2H-1,4-benzoxazin-3-yl)-, 1,1-dimethylethyl ester is 78959-40-7.
What is the molecular formula of Hydrazinecarboxylic acid, 2-(2H-1,4-benzoxazin-3-yl)-, 1,1-dimethylethyl ester?
The molecular formula of Hydrazinecarboxylic acid, 2-(2H-1,4-benzoxazin-3-yl)-, 1,1-dimethylethyl ester is C13H17N3O3.
What is the molecular weight of Hydrazinecarboxylic acid, 2-(2H-1,4-benzoxazin-3-yl)-, 1,1-dimethylethyl ester?
The molecular weight of Hydrazinecarboxylic acid, 2-(2H-1,4-benzoxazin-3-yl)-, 1,1-dimethylethyl ester is 263.13 g/mol.
Where can I buy Hydrazinecarboxylic acid, 2-(2H-1,4-benzoxazin-3-yl)-, 1,1-dimethylethyl ester?
You can request a quote for Hydrazinecarboxylic acid, 2-(2H-1,4-benzoxazin-3-yl)-, 1,1-dimethylethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hydrazinecarboxylic acid, 2-(2H-1,4-benzoxazin-3-yl)-, 1,1-dimethylethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Hydrazinecarboxylic acid, 2-(2H-1,4-benzoxazin-3-yl)-, 1,1-dimethylethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.