1-(2-amino-3,4-dicyano-5-methyl-1H-pyrrol-1-yl)urea
TL;DR: 1-(2-amino-3,4-dicyano-5-methyl-1H-pyrrol-1-yl)urea (CAS 372152-28-8) is a chemical compound with molecular formula C8H8N6O and molecular weight 204.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-amino-3,4-dicyano-5-methylpyrrol-1-yl)urea
Also Known As: (2-amino-3,4-dicyano-5-methylpyrrol-1-yl)urea, 1-(2-amino-3,4-dicyano-5-methyl-1H-pyrrol-1-yl)urea
| Molecular Formula | C8H8N6O |
|---|---|
| Molecular Weight | 204.08 g/mol |
| LogP | -0.25572 |
| Topological Polar Surface Area | 133.65 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 204.07596 |
| Heavy Atoms | 15 |
| Complexity | 463.1723 |
Chemical Identifiers
| CAS Number | 372152-28-8 |
|---|---|
| SMILES | CC1=C(C(=C(N1NC(=O)N)N)C#N)C#N |
Product Overview
1-(2-amino-3,4-dicyano-5-methyl-1H-pyrrol-1-yl)urea (CAS 372152-28-8), with molecular formula C8H8N6O and molecular weight 204.08 g/mol. IUPAC: (2-amino-3,4-dicyano-5-methylpyrrol-1-yl)urea.
Chemical Property Profile of 1-(2-amino-3,4-dicyano-5-methyl-1H-pyrrol-1-yl)urea
Property Insights of 1-(2-amino-3,4-dicyano-5-methyl-1H-pyrrol-1-yl)urea
The XLogP value of -0.25572 indicates that 1-(2-amino-3,4-dicyano-5-methyl-1H-pyrrol-1-yl)urea is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 133.65 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-amino-3,4-dicyano-5-methyl-1H-pyrrol-1-yl)urea. Following Lipinski's Rule of Five, 1-(2-amino-3,4-dicyano-5-methyl-1H-pyrrol-1-yl)urea has 3 hydrogen bond donor(s) and 4 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-(2-amino-3,4-dicyano-5-methyl-1H-pyrrol-1-yl)urea?
The CAS number of 1-(2-amino-3,4-dicyano-5-methyl-1H-pyrrol-1-yl)urea is 372152-28-8.
What is the molecular formula of 1-(2-amino-3,4-dicyano-5-methyl-1H-pyrrol-1-yl)urea?
The molecular formula of 1-(2-amino-3,4-dicyano-5-methyl-1H-pyrrol-1-yl)urea is C8H8N6O.
What is the molecular weight of 1-(2-amino-3,4-dicyano-5-methyl-1H-pyrrol-1-yl)urea?
The molecular weight of 1-(2-amino-3,4-dicyano-5-methyl-1H-pyrrol-1-yl)urea is 204.08 g/mol.
Where can I buy 1-(2-amino-3,4-dicyano-5-methyl-1H-pyrrol-1-yl)urea?
You can request a quote for 1-(2-amino-3,4-dicyano-5-methyl-1H-pyrrol-1-yl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-amino-3,4-dicyano-5-methyl-1H-pyrrol-1-yl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-amino-3,4-dicyano-5-methyl-1H-pyrrol-1-yl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.