2,2-二苯基-1,3-丙二醇氨基甲酸酯
TL;DR: 2,2-二苯基-1,3-丙二醇氨基甲酸酯 (CAS 25451-63-2) is a chemical compound with molecular formula C16H17NO3 and molecular weight 271.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-二苯基-1,3-丙二醇氨基甲酸酯
(3-hydroxy-2,2-diphenylpropyl) carbamate
Also Known As: 1,3-Propanediol, 2,2-diphenyl-, carbamate, 2,2-Diphenyl-1,3-propanediol carbamate, 2,2-Diphenyl-1,3-propanediol monocarbamate, 1, 2,2-diphenyl-, monocarbamate, 1,3-Propanediol, 2,2-diphenyl-, monocarbamate
| Molecular Formula | C16H17NO3 |
|---|---|
| Molecular Weight | 271.12 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 72.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 271.12085 |
| Heavy Atoms | 20 |
| Complexity | 289.0 |
Chemical Identifiers
| CAS Number | 25451-63-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(CO)(COC(=O)N)C2=CC=CC=C2 |
| InChIKey | BXUSEVHVYZZWLZ-UHFFFAOYSA-N |
Product Overview
2,2-二苯基-1,3-丙二醇氨基甲酸酯 (CAS 25451-63-2), with molecular formula C16H17NO3 and molecular weight 271.12 g/mol. IUPAC: (3-hydroxy-2,2-diphenylpropyl) carbamate.
Chemical Property Profile of 2,2-二苯基-1,3-丙二醇氨基甲酸酯
Property Insights of 2,2-二苯基-1,3-丙二醇氨基甲酸酯
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-二苯基-1,3-丙二醇氨基甲酸酯. The TPSA of 72.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2-二苯基-1,3-丙二醇氨基甲酸酯. Following Lipinski's Rule of Five, 2,2-二苯基-1,3-丙二醇氨基甲酸酯 has 2 hydrogen bond donor(s) and 3 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 2,2-二苯基-1,3-丙二醇氨基甲酸酯?
The CAS number of 2,2-二苯基-1,3-丙二醇氨基甲酸酯 is 25451-63-2.
What is the molecular formula of 2,2-二苯基-1,3-丙二醇氨基甲酸酯?
The molecular formula of 2,2-二苯基-1,3-丙二醇氨基甲酸酯 is C16H17NO3.
What is the molecular weight of 2,2-二苯基-1,3-丙二醇氨基甲酸酯?
The molecular weight of 2,2-二苯基-1,3-丙二醇氨基甲酸酯 is 271.12 g/mol.
Where can I buy 2,2-二苯基-1,3-丙二醇氨基甲酸酯?
You can request a quote for 2,2-二苯基-1,3-丙二醇氨基甲酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-二苯基-1,3-丙二醇氨基甲酸酯?
Yes, KEHONG BIO provides custom synthesis services for 2,2-二苯基-1,3-丙二醇氨基甲酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.