![5-[bis(2-chloroethyl)aminodiazenyl]-1H-pyrazole-4-carboxamide structure](/static/products/313/31384-87-9.png)
5-[bis(2-chloroethyl)aminodiazenyl]-1H-pyrazole-4-carboxamide
TL;DR: 5-[bis(2-chloroethyl)aminodiazenyl]-1H-pyrazole-4-carboxamide (CAS 31384-87-9) is a chemical compound with molecular formula C8H12Cl2N6O and molecular weight 278.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[bis(2-chloroethyl)aminodiazenyl]-1H-pyrazole-4-carboxamide
Also Known As: (3Z)-3-[bis(2-chloroethyl)aminohydrazinylidene]pyrazole-4-ca
| Molecular Formula | C8H12Cl2N6O |
|---|---|
| Molecular Weight | 278.04 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 99.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 278.04495 |
| Heavy Atoms | 17 |
| Complexity | 271.0 |
Chemical Identifiers
| CAS Number | 31384-87-9 |
|---|---|
| SMILES | C1=NNC(=C1C(=O)N)N=NN(CCCl)CCCl |
| InChIKey | ZFDNYVWDQMTPAS-UHFFFAOYSA-N |
Product Overview
5-[bis(2-chloroethyl)aminodiazenyl]-1H-pyrazole-4-carboxamide (CAS 31384-87-9), with molecular formula C8H12Cl2N6O and molecular weight 278.04 g/mol. IUPAC: 5-[bis(2-chloroethyl)aminodiazenyl]-1H-pyrazole-4-carboxamide.
Chemical Property Profile of 5-[bis(2-chloroethyl)aminodiazenyl]-1H-pyrazole-4-carboxamide
Property Insights of 5-[bis(2-chloroethyl)aminodiazenyl]-1H-pyrazole-4-carboxamide
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[bis(2-chloroethyl)aminodiazenyl]-1H-pyrazole-4-carboxamide. The TPSA of 99.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[bis(2-chloroethyl)aminodiazenyl]-1H-pyrazole-4-carboxamide. Following Lipinski's Rule of Five, 5-[bis(2-chloroethyl)aminodiazenyl]-1H-pyrazole-4-carboxamide has 2 hydrogen bond donor(s) and 5 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 5-[bis(2-chloroethyl)aminodiazenyl]-1H-pyrazole-4-carboxamide?
The CAS number of 5-[bis(2-chloroethyl)aminodiazenyl]-1H-pyrazole-4-carboxamide is 31384-87-9.
What is the molecular formula of 5-[bis(2-chloroethyl)aminodiazenyl]-1H-pyrazole-4-carboxamide?
The molecular formula of 5-[bis(2-chloroethyl)aminodiazenyl]-1H-pyrazole-4-carboxamide is C8H12Cl2N6O.
What is the molecular weight of 5-[bis(2-chloroethyl)aminodiazenyl]-1H-pyrazole-4-carboxamide?
The molecular weight of 5-[bis(2-chloroethyl)aminodiazenyl]-1H-pyrazole-4-carboxamide is 278.04 g/mol.
Where can I buy 5-[bis(2-chloroethyl)aminodiazenyl]-1H-pyrazole-4-carboxamide?
You can request a quote for 5-[bis(2-chloroethyl)aminodiazenyl]-1H-pyrazole-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[bis(2-chloroethyl)aminodiazenyl]-1H-pyrazole-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-[bis(2-chloroethyl)aminodiazenyl]-1H-pyrazole-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.