![tert-butyl N-[[amino(phenyl)methylidene]amino]carbamate structure](/static/products/1590/159016-25-8.webp)
tert-butyl N-[[amino(phenyl)methylidene]amino]carbamate
TL;DR: tert-butyl N-[[amino(phenyl)methylidene]amino]carbamate (CAS 159016-25-8) is a chemical compound with molecular formula C12H17N3O2 and molecular weight 235.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-[[amino(phenyl)methylidene]amino]carbamate
Also Known As: NCI60_029842, tert-butyl N-[[amino(phenyl)methylidene]amino]carbamate, tert-Butyl 2-(imino(phenyl)methyl)hydrazinecarboxylate, tert-butyl N-[[amino(phenyl)methylene]amino]carbamate, tert-Butyl 2-(amino(phenyl)methylene)hydrazinecarboxylate
| Molecular Formula | C12H17N3O2 |
|---|---|
| Molecular Weight | 235.13 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 76.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 235.13208 |
| Heavy Atoms | 17 |
| Complexity | 289.0 |
Chemical Identifiers
| CAS Number | 159016-25-8 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NN=C(C1=CC=CC=C1)N |
| InChIKey | UUWHNGLXDSXTLN-UHFFFAOYSA-N |
Product Overview
tert-butyl N-[[amino(phenyl)methylidene]amino]carbamate (CAS 159016-25-8), with molecular formula C12H17N3O2 and molecular weight 235.13 g/mol. IUPAC: tert-butyl N-[[amino(phenyl)methylidene]amino]carbamate.
Chemical Property Profile of tert-butyl N-[[amino(phenyl)methylidene]amino]carbamate
Property Insights of tert-butyl N-[[amino(phenyl)methylidene]amino]carbamate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-butyl N-[[amino(phenyl)methylidene]amino]carbamate. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for tert-butyl N-[[amino(phenyl)methylidene]amino]carbamate. Following Lipinski's Rule of Five, tert-butyl N-[[amino(phenyl)methylidene]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-[[amino(phenyl)methylidene]amino]carbamate?
The CAS number of tert-butyl N-[[amino(phenyl)methylidene]amino]carbamate is 159016-25-8.
What is the molecular formula of tert-butyl N-[[amino(phenyl)methylidene]amino]carbamate?
The molecular formula of tert-butyl N-[[amino(phenyl)methylidene]amino]carbamate is C12H17N3O2.
What is the molecular weight of tert-butyl N-[[amino(phenyl)methylidene]amino]carbamate?
The molecular weight of tert-butyl N-[[amino(phenyl)methylidene]amino]carbamate is 235.13 g/mol.
Where can I buy tert-butyl N-[[amino(phenyl)methylidene]amino]carbamate?
You can request a quote for tert-butyl N-[[amino(phenyl)methylidene]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-[[amino(phenyl)methylidene]amino]carbamate?
Yes, KEHONG BIO provides custom synthesis services for tert-butyl N-[[amino(phenyl)methylidene]amino]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.