Tolylene diurea
TL;DR: Tolylene diurea (CAS 10097-06-0) is a chemical compound with molecular formula C9H12N4O2 and molecular weight 208.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(carbamoylamino)-4-methylphenyl]urea
Also Known As: tolylene diurea, [3-(carbamoylamino)-4-methylphenyl]urea, [5-(carbamoylamino)-2-methylphenyl]urea, 1,1'-(4-methyl-1,3-phenylene)bisurea, [5-(carbamoylamino)-2-methyl-phenyl]urea
| Molecular Formula | C9H12N4O2 |
|---|---|
| Molecular Weight | 208.10 g/mol |
| LogP | 0.97622 |
| Topological Polar Surface Area | 110.24 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.09602 |
| Heavy Atoms | 15 |
| Complexity | 403.09885 |
Chemical Identifiers
| CAS Number | 10097-06-0 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)N)NC(=O)N |
Product Overview
Tolylene diurea (CAS 10097-06-0), with molecular formula C9H12N4O2 and molecular weight 208.10 g/mol. IUPAC: [3-(carbamoylamino)-4-methylphenyl]urea.
Chemical Property Profile of Tolylene diurea
Property Insights of Tolylene diurea
The XLogP value of 0.97622 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tolylene diurea. The TPSA of 110.24 Ų falls within the moderate polarity range, balancing permeability and solubility for Tolylene diurea. Following Lipinski's Rule of Five, Tolylene diurea has 4 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 Tolylene diurea?
The CAS number of Tolylene diurea is 10097-06-0.
What is the molecular formula of Tolylene diurea?
The molecular formula of Tolylene diurea is C9H12N4O2.
What is the molecular weight of Tolylene diurea?
The molecular weight of Tolylene diurea is 208.10 g/mol.
Where can I buy Tolylene diurea?
You can request a quote for Tolylene diurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tolylene diurea?
Yes, KEHONG BIO provides custom synthesis services for Tolylene diurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.