2-(Acetylcysteine)-N-isopropylacetanilide
TL;DR: 2-(Acetylcysteine)-N-isopropylacetanilide (CAS 36844-95-8) is a chemical compound with molecular formula C16H22N2O4S and molecular weight 338.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-2-acetamido-3-[2-oxo-2-(N-propan-2-ylanilino)ethyl]sulfanylpropanoic acid
Also Known As: Lead bis(12-hydroxystearate), 2-(Acetylcysteine)-N-isopropylacetanilide, L-Cysteine, N-acetyl-S-(2-((1-methylethyl)phenylamino)-2-oxoethyl)-, (2R)-2-acetamido-3-[2-oxo-2-(N-propan-2-ylanilino)ethyl]sulfanylpropanoic acid, n-acetyl-s-{2-oxo-2-[phenyl(propan-2-yl)amino]ethyl}-l-cysteine
| Molecular Formula | C16H22N2O4S |
|---|---|
| Molecular Weight | 338.13 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 338.13004 |
| Heavy Atoms | 23 |
| Complexity | 422.0 |
Chemical Identifiers
| CAS Number | 36844-95-8 |
|---|---|
| SMILES | CC(C)N(C1=CC=CC=C1)C(=O)CSC[C@@H](C(=O)O)NC(=O)C |
| InChIKey | BLNXLKHGHLFYJT-AWEZNQCLSA-N |
Product Overview
2-(Acetylcysteine)-N-isopropylacetanilide (CAS 36844-95-8), with molecular formula C16H22N2O4S and molecular weight 338.13 g/mol. IUPAC: (2R)-2-acetamido-3-[2-oxo-2-(N-propan-2-ylanilino)ethyl]sulfanylpropanoic acid.
Chemical Property Profile of 2-(Acetylcysteine)-N-isopropylacetanilide
Property Insights of 2-(Acetylcysteine)-N-isopropylacetanilide
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Acetylcysteine)-N-isopropylacetanilide. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Acetylcysteine)-N-isopropylacetanilide. Following Lipinski's Rule of Five, 2-(Acetylcysteine)-N-isopropylacetanilide has 2 hydrogen bond donor(s) and 5 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-(Acetylcysteine)-N-isopropylacetanilide?
The CAS number of 2-(Acetylcysteine)-N-isopropylacetanilide is 36844-95-8.
What is the molecular formula of 2-(Acetylcysteine)-N-isopropylacetanilide?
The molecular formula of 2-(Acetylcysteine)-N-isopropylacetanilide is C16H22N2O4S.
What is the molecular weight of 2-(Acetylcysteine)-N-isopropylacetanilide?
The molecular weight of 2-(Acetylcysteine)-N-isopropylacetanilide is 338.13 g/mol.
Where can I buy 2-(Acetylcysteine)-N-isopropylacetanilide?
You can request a quote for 2-(Acetylcysteine)-N-isopropylacetanilide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Acetylcysteine)-N-isopropylacetanilide?
Yes, KEHONG BIO provides custom synthesis services for 2-(Acetylcysteine)-N-isopropylacetanilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.