1-Aziridinecarboxamide, N,N'-(4-chloro-1,3-phenylene)bis-
TL;DR: 1-Aziridinecarboxamide, N,N'-(4-chloro-1,3-phenylene)bis- (CAS 64398-87-4) is a chemical compound with molecular formula C12H13ClN4O2 and molecular weight 280.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(aziridine-1-carbonylamino)-4-chlorophenyl]aziridine-1-carboxamide
Also Known As: NIOSH/CM6751500, 1-Aziridinecarboxamide, N,N'-(4-chloro-1,3-phenylene)bis-, N,N'-(4-Chloro-1,3-phenylene)bis-1-aziridinecarboxamide, N,N'-Bis-cycloethylenecarbamyl-2,4-diaminochlorobenzene, 1-Aziridinecarboxamide, N,N'-(4-chloro-m-phenylene)bis-
| Molecular Formula | C12H13ClN4O2 |
|---|---|
| Molecular Weight | 280.07 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 64.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 280.0727 |
| Heavy Atoms | 19 |
| Complexity | 384.0 |
Chemical Identifiers
| CAS Number | 64398-87-4 |
|---|---|
| SMILES | C1CN1C(=O)NC2=CC(=C(C=C2)Cl)NC(=O)N3CC3 |
| InChIKey | VMCQLYMQAVANFA-UHFFFAOYSA-N |
Product Overview
1-Aziridinecarboxamide, N,N'-(4-chloro-1,3-phenylene)bis- (CAS 64398-87-4), with molecular formula C12H13ClN4O2 and molecular weight 280.07 g/mol. IUPAC: N-[3-(aziridine-1-carbonylamino)-4-chlorophenyl]aziridine-1-carboxamide.
Chemical Property Profile of 1-Aziridinecarboxamide, N,N'-(4-chloro-1,3-phenylene)bis-
Property Insights of 1-Aziridinecarboxamide, N,N'-(4-chloro-1,3-phenylene)bis-
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Aziridinecarboxamide, N,N'-(4-chloro-1,3-phenylene)bis-. The TPSA of 64.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Aziridinecarboxamide, N,N'-(4-chloro-1,3-phenylene)bis-. Following Lipinski's Rule of Five, 1-Aziridinecarboxamide, N,N'-(4-chloro-1,3-phenylene)bis- has 2 hydrogen bond donor(s) and 2 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-Aziridinecarboxamide, N,N'-(4-chloro-1,3-phenylene)bis-?
The CAS number of 1-Aziridinecarboxamide, N,N'-(4-chloro-1,3-phenylene)bis- is 64398-87-4.
What is the molecular formula of 1-Aziridinecarboxamide, N,N'-(4-chloro-1,3-phenylene)bis-?
The molecular formula of 1-Aziridinecarboxamide, N,N'-(4-chloro-1,3-phenylene)bis- is C12H13ClN4O2.
What is the molecular weight of 1-Aziridinecarboxamide, N,N'-(4-chloro-1,3-phenylene)bis-?
The molecular weight of 1-Aziridinecarboxamide, N,N'-(4-chloro-1,3-phenylene)bis- is 280.07 g/mol.
Where can I buy 1-Aziridinecarboxamide, N,N'-(4-chloro-1,3-phenylene)bis-?
You can request a quote for 1-Aziridinecarboxamide, N,N'-(4-chloro-1,3-phenylene)bis- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Aziridinecarboxamide, N,N'-(4-chloro-1,3-phenylene)bis-?
Yes, KEHONG BIO provides custom synthesis services for 1-Aziridinecarboxamide, N,N'-(4-chloro-1,3-phenylene)bis- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.