(3,3-Diamino-1-imino-2-azaprop-2-enyl)methylphenylamine
TL;DR: (3,3-Diamino-1-imino-2-azaprop-2-enyl)methylphenylamine (CAS 60815-27-2) is a chemical compound with molecular formula C9H13N5 and molecular weight 191.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(diaminomethylidene)-1-methyl-1-phenylguanidine
Also Known As: 1-Methyl-1-phenylbiguanide, 1-methyl-1-phenyl-biguanide, 1-Phenyl-1-methyl-3-amidinoguanidine, 1-carbamimidamido-N-methyl-N-phenylmethanimidamide, 3-(diaminomethylidene)-1-methyl-1-phenylguanidine
| Molecular Formula | C9H13N5 |
|---|---|
| Molecular Weight | 191.12 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 91.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 191.1171 |
| Heavy Atoms | 14 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 60815-27-2 |
|---|---|
| SMILES | CN(C1=CC=CC=C1)C(=N)N=C(N)N |
| InChIKey | JQKRYDDFEZVDPR-UHFFFAOYSA-N |
Product Overview
(3,3-Diamino-1-imino-2-azaprop-2-enyl)methylphenylamine (CAS 60815-27-2), with molecular formula C9H13N5 and molecular weight 191.12 g/mol. IUPAC: 3-(diaminomethylidene)-1-methyl-1-phenylguanidine.
Chemical Property Profile of (3,3-Diamino-1-imino-2-azaprop-2-enyl)methylphenylamine
Property Insights of (3,3-Diamino-1-imino-2-azaprop-2-enyl)methylphenylamine
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3,3-Diamino-1-imino-2-azaprop-2-enyl)methylphenylamine. The TPSA of 91.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (3,3-Diamino-1-imino-2-azaprop-2-enyl)methylphenylamine. Following Lipinski's Rule of Five, (3,3-Diamino-1-imino-2-azaprop-2-enyl)methylphenylamine has 3 hydrogen bond donor(s) and 1 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 (3,3-Diamino-1-imino-2-azaprop-2-enyl)methylphenylamine?
The CAS number of (3,3-Diamino-1-imino-2-azaprop-2-enyl)methylphenylamine is 60815-27-2.
What is the molecular formula of (3,3-Diamino-1-imino-2-azaprop-2-enyl)methylphenylamine?
The molecular formula of (3,3-Diamino-1-imino-2-azaprop-2-enyl)methylphenylamine is C9H13N5.
What is the molecular weight of (3,3-Diamino-1-imino-2-azaprop-2-enyl)methylphenylamine?
The molecular weight of (3,3-Diamino-1-imino-2-azaprop-2-enyl)methylphenylamine is 191.12 g/mol.
Where can I buy (3,3-Diamino-1-imino-2-azaprop-2-enyl)methylphenylamine?
You can request a quote for (3,3-Diamino-1-imino-2-azaprop-2-enyl)methylphenylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3,3-Diamino-1-imino-2-azaprop-2-enyl)methylphenylamine?
Yes, KEHONG BIO provides custom synthesis services for (3,3-Diamino-1-imino-2-azaprop-2-enyl)methylphenylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.