1,3-Bis(2-chlorocyclohexyl)-1-nitrosourea
TL;DR: 1,3-Bis(2-chlorocyclohexyl)-1-nitrosourea (CAS 13907-67-0) is a chemical compound with molecular formula C13H21Cl2N3O2 and molecular weight 321.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-bis(2-chlorocyclohexyl)-1-nitrosourea
Also Known As: 1,3-bis(2-chlorocyclohexyl)-1-nitrosourea, KST-1B0775, N,N'-Bis(2-chlorocyclohexyl)-N-nitrosourea
| Molecular Formula | C13H21Cl2N3O2 |
|---|---|
| Molecular Weight | 321.10 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 321.10107 |
| Heavy Atoms | 20 |
| Complexity | 357.0 |
Chemical Identifiers
| CAS Number | 13907-67-0 |
|---|---|
| SMILES | C1CCC(C(C1)NC(=O)N(C2CCCCC2Cl)N=O)Cl |
| InChIKey | SFVKAXRGBNCKIT-UHFFFAOYSA-N |
Product Overview
1,3-Bis(2-chlorocyclohexyl)-1-nitrosourea (CAS 13907-67-0), with molecular formula C13H21Cl2N3O2 and molecular weight 321.10 g/mol. IUPAC: 1,3-bis(2-chlorocyclohexyl)-1-nitrosourea.
Chemical Property Profile of 1,3-Bis(2-chlorocyclohexyl)-1-nitrosourea
Property Insights of 1,3-Bis(2-chlorocyclohexyl)-1-nitrosourea
The XLogP value of 3.7 indicates that 1,3-Bis(2-chlorocyclohexyl)-1-nitrosourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Bis(2-chlorocyclohexyl)-1-nitrosourea. Following Lipinski's Rule of Five, 1,3-Bis(2-chlorocyclohexyl)-1-nitrosourea has 1 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 1,3-Bis(2-chlorocyclohexyl)-1-nitrosourea?
The CAS number of 1,3-Bis(2-chlorocyclohexyl)-1-nitrosourea is 13907-67-0.
What is the molecular formula of 1,3-Bis(2-chlorocyclohexyl)-1-nitrosourea?
The molecular formula of 1,3-Bis(2-chlorocyclohexyl)-1-nitrosourea is C13H21Cl2N3O2.
What is the molecular weight of 1,3-Bis(2-chlorocyclohexyl)-1-nitrosourea?
The molecular weight of 1,3-Bis(2-chlorocyclohexyl)-1-nitrosourea is 321.10 g/mol.
Where can I buy 1,3-Bis(2-chlorocyclohexyl)-1-nitrosourea?
You can request a quote for 1,3-Bis(2-chlorocyclohexyl)-1-nitrosourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Bis(2-chlorocyclohexyl)-1-nitrosourea?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Bis(2-chlorocyclohexyl)-1-nitrosourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.