![tert-butyl N-[[1-amino-2-(4-chlorophenyl)ethylidene]amino]carbamate structure](/static/products/1590/159016-24-7.webp)
tert-butyl N-[[1-amino-2-(4-chlorophenyl)ethylidene]amino]carbamate
TL;DR: tert-butyl N-[[1-amino-2-(4-chlorophenyl)ethylidene]amino]carbamate (CAS 159016-24-7) is a chemical compound with molecular formula C13H18ClN3O2 and molecular weight 283.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-[[1-amino-2-(4-chlorophenyl)ethylidene]amino]carbamate
Also Known As: NCI60_030237, N'-[1-amino-2-(4-chlorophenyl)ethylidene](tert-butoxy)carbohydrazide, tert-butyl N-[[1-amino-2-(4-chlorophenyl)ethylidene]amino]carbamate, N'-[1-AMINO-2-(4-CHLOROPHENYL)ETHYLIDENE]HYDRAZINECARBOXYLIC ACID TERT-BUTYL ESTER, N'-[1-Amino-2-(4-chlorophenyl)ethylidene]-hydrazinecarboxylic acid tert-butyl ester
| Molecular Formula | C13H18ClN3O2 |
|---|---|
| Molecular Weight | 283.11 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 76.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 283.10876 |
| Heavy Atoms | 19 |
| Complexity | 331.0 |
Chemical Identifiers
| CAS Number | 159016-24-7 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NN=C(CC1=CC=C(C=C1)Cl)N |
| InChIKey | LNCQFLSZOPKRQA-UHFFFAOYSA-N |
Product Overview
tert-butyl N-[[1-amino-2-(4-chlorophenyl)ethylidene]amino]carbamate (CAS 159016-24-7), with molecular formula C13H18ClN3O2 and molecular weight 283.11 g/mol. IUPAC: tert-butyl N-[[1-amino-2-(4-chlorophenyl)ethylidene]amino]carbamate.
Chemical Property Profile of tert-butyl N-[[1-amino-2-(4-chlorophenyl)ethylidene]amino]carbamate
Property Insights of tert-butyl N-[[1-amino-2-(4-chlorophenyl)ethylidene]amino]carbamate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-butyl N-[[1-amino-2-(4-chlorophenyl)ethylidene]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-(4-chlorophenyl)ethylidene]amino]carbamate. Following Lipinski's Rule of Five, tert-butyl N-[[1-amino-2-(4-chlorophenyl)ethylidene]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-(4-chlorophenyl)ethylidene]amino]carbamate?
The CAS number of tert-butyl N-[[1-amino-2-(4-chlorophenyl)ethylidene]amino]carbamate is 159016-24-7.
What is the molecular formula of tert-butyl N-[[1-amino-2-(4-chlorophenyl)ethylidene]amino]carbamate?
The molecular formula of tert-butyl N-[[1-amino-2-(4-chlorophenyl)ethylidene]amino]carbamate is C13H18ClN3O2.
What is the molecular weight of tert-butyl N-[[1-amino-2-(4-chlorophenyl)ethylidene]amino]carbamate?
The molecular weight of tert-butyl N-[[1-amino-2-(4-chlorophenyl)ethylidene]amino]carbamate is 283.11 g/mol.
Where can I buy tert-butyl N-[[1-amino-2-(4-chlorophenyl)ethylidene]amino]carbamate?
You can request a quote for tert-butyl N-[[1-amino-2-(4-chlorophenyl)ethylidene]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-(4-chlorophenyl)ethylidene]amino]carbamate?
Yes, KEHONG BIO provides custom synthesis services for tert-butyl N-[[1-amino-2-(4-chlorophenyl)ethylidene]amino]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.