Bicarbamimide, N-cyclohexyl-2-phenyl-
TL;DR: Bicarbamimide, N-cyclohexyl-2-phenyl- (CAS 3657-61-2) is a chemical compound with molecular formula C14H17N3O2 and molecular weight 259.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cyclohexyl-2-phenyl-1,2,4-triazolidine-3,5-dione
Also Known As: N-Cyclohexyl-2-phenylbicarbamimide, NIOSH/DT4393350, 2-Cyclohexyl-3-phenylbicarbamimide, BICARBAMIMIDE, N-CYCLOHEXYL-2-PHENYL-, Bicarbamimide, 2-cyclohexyl-3-phenyl-
| Molecular Formula | C14H17N3O2 |
|---|---|
| Molecular Weight | 259.13 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 52.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 259.13208 |
| Heavy Atoms | 19 |
| Complexity | 360.0 |
Chemical Identifiers
| CAS Number | 3657-61-2 |
|---|---|
| SMILES | C1CCC(CC1)N2C(=O)NC(=O)N2C3=CC=CC=C3 |
| InChIKey | BQRGAIBZOJHBDC-UHFFFAOYSA-N |
Product Overview
Bicarbamimide, N-cyclohexyl-2-phenyl- (CAS 3657-61-2), with molecular formula C14H17N3O2 and molecular weight 259.13 g/mol. IUPAC: 1-cyclohexyl-2-phenyl-1,2,4-triazolidine-3,5-dione.
Chemical Property Profile of Bicarbamimide, N-cyclohexyl-2-phenyl-
Property Insights of Bicarbamimide, N-cyclohexyl-2-phenyl-
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bicarbamimide, N-cyclohexyl-2-phenyl-. With a topological polar surface area (TPSA) of 52.7 Ų, Bicarbamimide, N-cyclohexyl-2-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bicarbamimide, N-cyclohexyl-2-phenyl- has 1 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 Bicarbamimide, N-cyclohexyl-2-phenyl-?
The CAS number of Bicarbamimide, N-cyclohexyl-2-phenyl- is 3657-61-2.
What is the molecular formula of Bicarbamimide, N-cyclohexyl-2-phenyl-?
The molecular formula of Bicarbamimide, N-cyclohexyl-2-phenyl- is C14H17N3O2.
What is the molecular weight of Bicarbamimide, N-cyclohexyl-2-phenyl-?
The molecular weight of Bicarbamimide, N-cyclohexyl-2-phenyl- is 259.13 g/mol.
Where can I buy Bicarbamimide, N-cyclohexyl-2-phenyl-?
You can request a quote for Bicarbamimide, N-cyclohexyl-2-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bicarbamimide, N-cyclohexyl-2-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for Bicarbamimide, N-cyclohexyl-2-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.