![rac-benzyl N-[(3R,4S)-4-hydroxythiolan-3-yl]carbamate structure](/static/products/560/56018-18-9.png)
rac-benzyl N-[(3R,4S)-4-hydroxythiolan-3-yl]carbamate
TL;DR: rac-benzyl N-[(3R,4S)-4-hydroxythiolan-3-yl]carbamate (CAS 56018-18-9) is a chemical compound with molecular formula C12H15NO3S and molecular weight 253.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl N-[(3R,4S)-4-hydroxythiolan-3-yl]carbamate
Also Known As: Carbamicacid, -,phenylmethylester,cis-, rac-benzyl N-[(3R,4S)-4-hydroxythiolan-3-yl]carbamate
| Molecular Formula | C12H15NO3S |
|---|---|
| Molecular Weight | 253.08 g/mol |
| LogP | 1.3891 |
| Topological Polar Surface Area | 58.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 253.07727 |
| Heavy Atoms | 17 |
| Complexity | 371.27332 |
Chemical Identifiers
| CAS Number | 56018-18-9 |
|---|---|
| SMILES | C1[C@@H]([C@@H](CS1)O)NC(=O)OCC2=CC=CC=C2 |
Product Overview
rac-benzyl N-[(3R,4S)-4-hydroxythiolan-3-yl]carbamate (CAS 56018-18-9), with molecular formula C12H15NO3S and molecular weight 253.08 g/mol. IUPAC: benzyl N-[(3R,4S)-4-hydroxythiolan-3-yl]carbamate.
Chemical Property Profile of rac-benzyl N-[(3R,4S)-4-hydroxythiolan-3-yl]carbamate
Property Insights of rac-benzyl N-[(3R,4S)-4-hydroxythiolan-3-yl]carbamate
The XLogP value of 1.3891 suggests moderate lipophilicity, balancing water solubility and membrane permeability for rac-benzyl N-[(3R,4S)-4-hydroxythiolan-3-yl]carbamate. With a topological polar surface area (TPSA) of 58.56 Ų, rac-benzyl N-[(3R,4S)-4-hydroxythiolan-3-yl]carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, rac-benzyl N-[(3R,4S)-4-hydroxythiolan-3-yl]carbamate 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 rac-benzyl N-[(3R,4S)-4-hydroxythiolan-3-yl]carbamate?
The CAS number of rac-benzyl N-[(3R,4S)-4-hydroxythiolan-3-yl]carbamate is 56018-18-9.
What is the molecular formula of rac-benzyl N-[(3R,4S)-4-hydroxythiolan-3-yl]carbamate?
The molecular formula of rac-benzyl N-[(3R,4S)-4-hydroxythiolan-3-yl]carbamate is C12H15NO3S.
What is the molecular weight of rac-benzyl N-[(3R,4S)-4-hydroxythiolan-3-yl]carbamate?
The molecular weight of rac-benzyl N-[(3R,4S)-4-hydroxythiolan-3-yl]carbamate is 253.08 g/mol.
Where can I buy rac-benzyl N-[(3R,4S)-4-hydroxythiolan-3-yl]carbamate?
You can request a quote for rac-benzyl N-[(3R,4S)-4-hydroxythiolan-3-yl]carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for rac-benzyl N-[(3R,4S)-4-hydroxythiolan-3-yl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for rac-benzyl N-[(3R,4S)-4-hydroxythiolan-3-yl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.