1-phenyl-3-(1H-pyrrol-2-ylmethylideneamino)urea
TL;DR: 1-phenyl-3-(1H-pyrrol-2-ylmethylideneamino)urea (CAS 119034-14-9) is a chemical compound with molecular formula C12H12N4O and molecular weight 228.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-3-(1H-pyrrol-2-ylmethylideneamino)urea
Also Known As: 1-phenyl-3-(1H-pyrrol-2-ylmethylideneamino)urea, Benzoic acid,4-methoxy-, 2-(1H-pyrrol-2-ylmethylene)hydrazide, N-Phenyl-2-(1H-pyrrol-2-ylmethylene)hydrazinecarboxamide, N-Phenyl-2-[(1H-pyrrol-2-yl)methylidene]hydrazine-1-carboxamide
| Molecular Formula | C12H12N4O |
|---|---|
| Molecular Weight | 228.10 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 69.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 228.1011 |
| Heavy Atoms | 17 |
| Complexity | 274.0 |
Chemical Identifiers
| CAS Number | 119034-14-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)NN=CC2=CC=CN2 |
| InChIKey | NWTYISUZWFHEEV-UHFFFAOYSA-N |
Product Overview
1-phenyl-3-(1H-pyrrol-2-ylmethylideneamino)urea (CAS 119034-14-9), with molecular formula C12H12N4O and molecular weight 228.10 g/mol. IUPAC: 1-phenyl-3-(1H-pyrrol-2-ylmethylideneamino)urea.
Chemical Property Profile of 1-phenyl-3-(1H-pyrrol-2-ylmethylideneamino)urea
Property Insights of 1-phenyl-3-(1H-pyrrol-2-ylmethylideneamino)urea
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-phenyl-3-(1H-pyrrol-2-ylmethylideneamino)urea. The TPSA of 69.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-phenyl-3-(1H-pyrrol-2-ylmethylideneamino)urea. Following Lipinski's Rule of Five, 1-phenyl-3-(1H-pyrrol-2-ylmethylideneamino)urea has 3 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-phenyl-3-(1H-pyrrol-2-ylmethylideneamino)urea?
The CAS number of 1-phenyl-3-(1H-pyrrol-2-ylmethylideneamino)urea is 119034-14-9.
What is the molecular formula of 1-phenyl-3-(1H-pyrrol-2-ylmethylideneamino)urea?
The molecular formula of 1-phenyl-3-(1H-pyrrol-2-ylmethylideneamino)urea is C12H12N4O.
What is the molecular weight of 1-phenyl-3-(1H-pyrrol-2-ylmethylideneamino)urea?
The molecular weight of 1-phenyl-3-(1H-pyrrol-2-ylmethylideneamino)urea is 228.10 g/mol.
Where can I buy 1-phenyl-3-(1H-pyrrol-2-ylmethylideneamino)urea?
You can request a quote for 1-phenyl-3-(1H-pyrrol-2-ylmethylideneamino)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-phenyl-3-(1H-pyrrol-2-ylmethylideneamino)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-phenyl-3-(1H-pyrrol-2-ylmethylideneamino)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.