Urea, N-1H-benzotriazol-6-yl-N'-phenyl-
TL;DR: Urea, N-1H-benzotriazol-6-yl-N'-phenyl- (CAS 18811-70-6) is a chemical compound with molecular formula C13H11N5O and molecular weight 253.09636 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2H-benzotriazol-5-yl)-3-phenylurea
Also Known As: 1-(1H-Benzotriazol-5-yl)-3-phenylurea, N-1H-Benzotriazol-5-yl-N'-phenylurea, 1-(2H-benzotriazol-5-yl)-3-phenylurea, Urea, N-1H-benzotriazol-5-yl-N'-phenyl-, Urea, N-1H-benzotriazol-6-yl-N'-phenyl-
Technical Specifications
| Molecular Formula | C13H11N5O |
| Molecular Weight | 253.09636 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 82.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 253.09636 Da |
| Heavy Atoms | 19 |
| Complexity | 318.0 |
| SMILES | C1=CC=C(C=C1)NC(=O)NC2=CC3=NNN=C3C=C2 |
| InChIKey | POZVYOVYIZCFLB-UHFFFAOYSA-N |
Chemical Property Profile of Urea, N-1H-benzotriazol-6-yl-N'-phenyl-
Property Insights of Urea, N-1H-benzotriazol-6-yl-N'-phenyl-
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, N-1H-benzotriazol-6-yl-N'-phenyl-. The TPSA of 82.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Urea, N-1H-benzotriazol-6-yl-N'-phenyl-. Following Lipinski's Rule of Five, Urea, N-1H-benzotriazol-6-yl-N'-phenyl- has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Urea, N-1H-benzotriazol-6-yl-N'-phenyl-?
The CAS number of Urea, N-1H-benzotriazol-6-yl-N'-phenyl- is 18811-70-6.
What is the molecular formula of Urea, N-1H-benzotriazol-6-yl-N'-phenyl-?
The molecular formula of Urea, N-1H-benzotriazol-6-yl-N'-phenyl- is C13H11N5O.
What is the molecular weight of Urea, N-1H-benzotriazol-6-yl-N'-phenyl-?
The molecular weight of Urea, N-1H-benzotriazol-6-yl-N'-phenyl- is 253.09636 g/mol.
Where can I buy Urea, N-1H-benzotriazol-6-yl-N'-phenyl-?
You can request a quote for Urea, N-1H-benzotriazol-6-yl-N'-phenyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Urea, N-1H-benzotriazol-6-yl-N'-phenyl-?
Yes, CoreyChem provides custom synthesis services for Urea, N-1H-benzotriazol-6-yl-N'-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.