(2-巯基环戊基)N-苯甲酰氨基甲酸酯
TL;DR: (2-巯基环戊基)N-苯甲酰氨基甲酸酯 (CAS 7621-74-1) is a chemical compound with molecular formula C13H15NO3S and molecular weight 265.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-巯基环戊基)N-苯甲酰氨基甲酸酯
(2-sulfanylcyclopentyl) N-benzoylcarbamate
Also Known As: N-benzoylcarbamate, NCIOpen2_002525, 2-sulfanylcyclopentyl benzoylcarbamate, (2-sulfanylcyclopentyl) N-benzoylcarbamate, (2-sulfanylcyclopentyl) N-(benzoyl)carbamate
| Molecular Formula | C13H15NO3S |
|---|---|
| Molecular Weight | 265.08 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 56.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 265.07727 |
| Heavy Atoms | 18 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 7621-74-1 |
|---|---|
| SMILES | C1CC(C(C1)S)OC(=O)NC(=O)C2=CC=CC=C2 |
| InChIKey | DJHXJAOLUCERPV-UHFFFAOYSA-N |
Product Overview
(2-巯基环戊基)N-苯甲酰氨基甲酸酯 (CAS 7621-74-1), with molecular formula C13H15NO3S and molecular weight 265.08 g/mol. IUPAC: (2-sulfanylcyclopentyl) N-benzoylcarbamate.
Chemical Property Profile of (2-巯基环戊基)N-苯甲酰氨基甲酸酯
Property Insights of (2-巯基环戊基)N-苯甲酰氨基甲酸酯
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-巯基环戊基)N-苯甲酰氨基甲酸酯. With a topological polar surface area (TPSA) of 56.4 Ų, (2-巯基环戊基)N-苯甲酰氨基甲酸酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-巯基环戊基)N-苯甲酰氨基甲酸酯 has 2 hydrogen bond donor(s) and 4 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-巯基环戊基)N-苯甲酰氨基甲酸酯?
The CAS number of (2-巯基环戊基)N-苯甲酰氨基甲酸酯 is 7621-74-1.
What is the molecular formula of (2-巯基环戊基)N-苯甲酰氨基甲酸酯?
The molecular formula of (2-巯基环戊基)N-苯甲酰氨基甲酸酯 is C13H15NO3S.
What is the molecular weight of (2-巯基环戊基)N-苯甲酰氨基甲酸酯?
The molecular weight of (2-巯基环戊基)N-苯甲酰氨基甲酸酯 is 265.08 g/mol.
Where can I buy (2-巯基环戊基)N-苯甲酰氨基甲酸酯?
You can request a quote for (2-巯基环戊基)N-苯甲酰氨基甲酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-巯基环戊基)N-苯甲酰氨基甲酸酯?
Yes, KEHONG BIO provides custom synthesis services for (2-巯基环戊基)N-苯甲酰氨基甲酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.