1-Phenyl-3-(4-phenylbut-3-en-2-ylideneamino)urea
TL;DR: 1-Phenyl-3-(4-phenylbut-3-en-2-ylideneamino)urea (CAS 17014-34-5) is a chemical compound with molecular formula C17H17N3O and molecular weight 279.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-3-(4-phenylbut-3-en-2-ylideneamino)urea
Also Known As: 1-phenyl-3-(4-phenylbut-3-en-2-ylideneamino)urea, Benzylideneacetone 4-phenylsemicarbazone, 4-Phenyl-3-buten-2-one 4-phenyl semicarbazone, 4-PHENYL-3-BUTEN-2-ONE N-PHENYLSEMICARBAZONE
| Molecular Formula | C17H17N3O |
|---|---|
| Molecular Weight | 279.14 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 53.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 279.13718 |
| Heavy Atoms | 21 |
| Complexity | 377.0 |
Chemical Identifiers
| CAS Number | 17014-34-5 |
|---|---|
| SMILES | CC(=NNC(=O)NC1=CC=CC=C1)C=CC2=CC=CC=C2 |
| InChIKey | GHYASIZGQZSKIH-UHFFFAOYSA-N |
Product Overview
1-Phenyl-3-(4-phenylbut-3-en-2-ylideneamino)urea (CAS 17014-34-5), with molecular formula C17H17N3O and molecular weight 279.14 g/mol. IUPAC: 1-phenyl-3-(4-phenylbut-3-en-2-ylideneamino)urea.
Chemical Property Profile of 1-Phenyl-3-(4-phenylbut-3-en-2-ylideneamino)urea
Property Insights of 1-Phenyl-3-(4-phenylbut-3-en-2-ylideneamino)urea
The XLogP value of 3.2 indicates that 1-Phenyl-3-(4-phenylbut-3-en-2-ylideneamino)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.5 Ų, 1-Phenyl-3-(4-phenylbut-3-en-2-ylideneamino)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Phenyl-3-(4-phenylbut-3-en-2-ylideneamino)urea 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-Phenyl-3-(4-phenylbut-3-en-2-ylideneamino)urea?
The CAS number of 1-Phenyl-3-(4-phenylbut-3-en-2-ylideneamino)urea is 17014-34-5.
What is the molecular formula of 1-Phenyl-3-(4-phenylbut-3-en-2-ylideneamino)urea?
The molecular formula of 1-Phenyl-3-(4-phenylbut-3-en-2-ylideneamino)urea is C17H17N3O.
What is the molecular weight of 1-Phenyl-3-(4-phenylbut-3-en-2-ylideneamino)urea?
The molecular weight of 1-Phenyl-3-(4-phenylbut-3-en-2-ylideneamino)urea is 279.14 g/mol.
Where can I buy 1-Phenyl-3-(4-phenylbut-3-en-2-ylideneamino)urea?
You can request a quote for 1-Phenyl-3-(4-phenylbut-3-en-2-ylideneamino)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-(4-phenylbut-3-en-2-ylideneamino)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenyl-3-(4-phenylbut-3-en-2-ylideneamino)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.