1,3-二苯基脲
TL;DR: 1,3-二苯基脲 (CAS 102-07-8) is a chemical compound with molecular formula C13H12N2O and molecular weight 212.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-二苯基脲
1,3-diphenylurea
Also Known As: 1,3-Diphenylurea, Diphenylurea, N,N'-Diphenylurea, CARBANILIDE, Diphenylcarbamide
| Molecular Formula | C13H12N2O |
|---|---|
| Molecular Weight | 212.09 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 212.09496 |
| Heavy Atoms | 16 |
| Complexity | 196.0 |
| Melting Point | 237.8 °C |
| Boiling Point | 262.2 °C at 760 mmHg (Decomposes) |
| Density | 1.239 |
| Solubility | less than 0.1 mg/mL at 64 °F (NTP, 1992) |
Chemical Identifiers
| CAS Number | 102-07-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)NC2=CC=CC=C2 |
| InChIKey | GWEHVDNNLFDJLR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-二苯基脲 (CAS 102-07-8), with molecular formula C13H12N2O and molecular weight 212.09 g/mol. IUPAC: 1,3-diphenylurea.
Chemical Property Profile of 1,3-二苯基脲
Property Insights of 1,3-二苯基脲
The XLogP value of 3.0 indicates that 1,3-二苯基脲 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.1 Ų, 1,3-二苯基脲 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-二苯基脲 has 2 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 1,3-二苯基脲?
The CAS number of 1,3-二苯基脲 is 102-07-8.
What is the molecular formula of 1,3-二苯基脲?
The molecular formula of 1,3-二苯基脲 is C13H12N2O.
What is the molecular weight of 1,3-二苯基脲?
The molecular weight of 1,3-二苯基脲 is 212.09 g/mol.
Where can I buy 1,3-二苯基脲?
You can request a quote for 1,3-二苯基脲 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-二苯基脲?
Yes, KEHONG BIO provides custom synthesis services for 1,3-二苯基脲 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.