CYCLOHEPTANECARBAMIC ACID, 3,3-BIS(p-FLUOROPHENYL)-1-PROPYNYL ESTER
TL;DR: CYCLOHEPTANECARBAMIC ACID, 3,3-BIS(p-FLUOROPHENYL)-1-PROPYNYL ESTER (CAS 101052-66-8) is a chemical compound with molecular formula C23H23F2NO2 and molecular weight 383.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-bis(4-fluorophenyl)prop-1-ynyl N-cycloheptylcarbamate
Also Known As: 3,3-bis(4-fluorophenyl)prop-1-ynyl N-cycloheptylcarbamate, CYCLOHEPTANECARBAMIC ACID, 3,3-BIS(p-FLUOROPHENYL)-1-PROPYNYL ESTER, Di-(p-fluorophenyl)propynyl-N-cycloheptyl-carbamate, Di-(4-Fluorophenyl)Propynyl-N-Cycloheptyl-Carbamate, 3,3-bis(4-fluorophenyl)-1-propyn-1-yl cycloheptylcarbamate
| Molecular Formula | C23H23F2NO2 |
|---|---|
| Molecular Weight | 383.17 g/mol |
| LogP | 6.4 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 383.16968 |
| Heavy Atoms | 28 |
| Complexity | 523.0 |
Chemical Identifiers
| CAS Number | 101052-66-8 |
|---|---|
| SMILES | C1CCCC(CC1)NC(=O)OC#CC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F |
| InChIKey | SJOLDGBCZGNCMT-UHFFFAOYSA-N |
Product Overview
CYCLOHEPTANECARBAMIC ACID, 3,3-BIS(p-FLUOROPHENYL)-1-PROPYNYL ESTER (CAS 101052-66-8), with molecular formula C23H23F2NO2 and molecular weight 383.17 g/mol. IUPAC: 3,3-bis(4-fluorophenyl)prop-1-ynyl N-cycloheptylcarbamate.
Chemical Property Profile of CYCLOHEPTANECARBAMIC ACID, 3,3-BIS(p-FLUOROPHENYL)-1-PROPYNYL ESTER
Property Insights of CYCLOHEPTANECARBAMIC ACID, 3,3-BIS(p-FLUOROPHENYL)-1-PROPYNYL ESTER
The XLogP value of 6.4 indicates that CYCLOHEPTANECARBAMIC ACID, 3,3-BIS(p-FLUOROPHENYL)-1-PROPYNYL ESTER is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, CYCLOHEPTANECARBAMIC ACID, 3,3-BIS(p-FLUOROPHENYL)-1-PROPYNYL ESTER exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CYCLOHEPTANECARBAMIC ACID, 3,3-BIS(p-FLUOROPHENYL)-1-PROPYNYL ESTER has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CYCLOHEPTANECARBAMIC ACID, 3,3-BIS(p-FLUOROPHENYL)-1-PROPYNYL ESTER?
The CAS number of CYCLOHEPTANECARBAMIC ACID, 3,3-BIS(p-FLUOROPHENYL)-1-PROPYNYL ESTER is 101052-66-8.
What is the molecular formula of CYCLOHEPTANECARBAMIC ACID, 3,3-BIS(p-FLUOROPHENYL)-1-PROPYNYL ESTER?
The molecular formula of CYCLOHEPTANECARBAMIC ACID, 3,3-BIS(p-FLUOROPHENYL)-1-PROPYNYL ESTER is C23H23F2NO2.
What is the molecular weight of CYCLOHEPTANECARBAMIC ACID, 3,3-BIS(p-FLUOROPHENYL)-1-PROPYNYL ESTER?
The molecular weight of CYCLOHEPTANECARBAMIC ACID, 3,3-BIS(p-FLUOROPHENYL)-1-PROPYNYL ESTER is 383.17 g/mol.
Where can I buy CYCLOHEPTANECARBAMIC ACID, 3,3-BIS(p-FLUOROPHENYL)-1-PROPYNYL ESTER?
You can request a quote for CYCLOHEPTANECARBAMIC ACID, 3,3-BIS(p-FLUOROPHENYL)-1-PROPYNYL ESTER directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CYCLOHEPTANECARBAMIC ACID, 3,3-BIS(p-FLUOROPHENYL)-1-PROPYNYL ESTER?
Yes, KEHONG BIO provides custom synthesis services for CYCLOHEPTANECARBAMIC ACID, 3,3-BIS(p-FLUOROPHENYL)-1-PROPYNYL ESTER and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.