![tert-butyl N-[(1-amino-2-phenylethylidene)amino]carbamate structure](/static/products/1590/159016-22-5.webp)
tert-butyl N-[(1-amino-2-phenylethylidene)amino]carbamate
TL;DR: tert-butyl N-[(1-amino-2-phenylethylidene)amino]carbamate (CAS 159016-22-5) is a chemical compound with molecular formula C13H19N3O2 and molecular weight 249.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-[(1-amino-2-phenylethylidene)amino]carbamate
Also Known As: NCI60_029841, N'-(1-amino-2-phenylethylidene)(tert-butoxy)carbohydrazide, tert-butyl N-[(1-amino-2-phenylethylidene)amino]carbamate, tert-Butyl 2-(2-phenylethanimidoyl)hydrazinecarboxylate, tert-butyl N-[(1-amino-2-phenyl-ethylidene)amino]carbamate
| Molecular Formula | C13H19N3O2 |
|---|---|
| Molecular Weight | 249.15 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 76.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 249.14772 |
| Heavy Atoms | 18 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 159016-22-5 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NN=C(CC1=CC=CC=C1)N |
| InChIKey | OFHSGIRZKLLPRM-UHFFFAOYSA-N |
Product Overview
tert-butyl N-[(1-amino-2-phenylethylidene)amino]carbamate (CAS 159016-22-5), with molecular formula C13H19N3O2 and molecular weight 249.15 g/mol. IUPAC: tert-butyl N-[(1-amino-2-phenylethylidene)amino]carbamate.
Chemical Property Profile of tert-butyl N-[(1-amino-2-phenylethylidene)amino]carbamate
Property Insights of tert-butyl N-[(1-amino-2-phenylethylidene)amino]carbamate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-butyl N-[(1-amino-2-phenylethylidene)amino]carbamate. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for tert-butyl N-[(1-amino-2-phenylethylidene)amino]carbamate. Following Lipinski's Rule of Five, tert-butyl N-[(1-amino-2-phenylethylidene)amino]carbamate has 2 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 tert-butyl N-[(1-amino-2-phenylethylidene)amino]carbamate?
The CAS number of tert-butyl N-[(1-amino-2-phenylethylidene)amino]carbamate is 159016-22-5.
What is the molecular formula of tert-butyl N-[(1-amino-2-phenylethylidene)amino]carbamate?
The molecular formula of tert-butyl N-[(1-amino-2-phenylethylidene)amino]carbamate is C13H19N3O2.
What is the molecular weight of tert-butyl N-[(1-amino-2-phenylethylidene)amino]carbamate?
The molecular weight of tert-butyl N-[(1-amino-2-phenylethylidene)amino]carbamate is 249.15 g/mol.
Where can I buy tert-butyl N-[(1-amino-2-phenylethylidene)amino]carbamate?
You can request a quote for tert-butyl N-[(1-amino-2-phenylethylidene)amino]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-[(1-amino-2-phenylethylidene)amino]carbamate?
Yes, KEHONG BIO provides custom synthesis services for tert-butyl N-[(1-amino-2-phenylethylidene)amino]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.