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2-[(2-Amino-2-oxoethyl)sulfanyl]-2-phenylbutanamide
TL;DR: 2-[(2-Amino-2-oxoethyl)sulfanyl]-2-phenylbutanamide (CAS 63133-90-4) is a chemical compound with molecular formula C12H16N2O2S and molecular weight 252.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-amino-2-oxoethyl)sulfanyl-2-phenylbutanamide
Also Known As: 2-(2-amino-2-oxoethyl)sulfanyl-2-phenylbutanamide, 2-[(2-amino-2-oxoethyl)sulfanyl]-2-phenylbutanamide, 2-carbamoylmethylsulfanyl-2-phenyl-butyric acid amide
| Molecular Formula | C12H16N2O2S |
|---|---|
| Molecular Weight | 252.09 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 252.09325 |
| Heavy Atoms | 17 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 63133-90-4 |
|---|---|
| SMILES | CCC(C1=CC=CC=C1)(C(=O)N)SCC(=O)N |
| InChIKey | KTRYGOHIGFWGSZ-UHFFFAOYSA-N |
Product Overview
2-[(2-Amino-2-oxoethyl)sulfanyl]-2-phenylbutanamide (CAS 63133-90-4), with molecular formula C12H16N2O2S and molecular weight 252.09 g/mol. IUPAC: 2-(2-amino-2-oxoethyl)sulfanyl-2-phenylbutanamide.
Chemical Property Profile of 2-[(2-Amino-2-oxoethyl)sulfanyl]-2-phenylbutanamide
Property Insights of 2-[(2-Amino-2-oxoethyl)sulfanyl]-2-phenylbutanamide
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(2-Amino-2-oxoethyl)sulfanyl]-2-phenylbutanamide. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(2-Amino-2-oxoethyl)sulfanyl]-2-phenylbutanamide. Following Lipinski's Rule of Five, 2-[(2-Amino-2-oxoethyl)sulfanyl]-2-phenylbutanamide 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-Amino-2-oxoethyl)sulfanyl]-2-phenylbutanamide?
The CAS number of 2-[(2-Amino-2-oxoethyl)sulfanyl]-2-phenylbutanamide is 63133-90-4.
What is the molecular formula of 2-[(2-Amino-2-oxoethyl)sulfanyl]-2-phenylbutanamide?
The molecular formula of 2-[(2-Amino-2-oxoethyl)sulfanyl]-2-phenylbutanamide is C12H16N2O2S.
What is the molecular weight of 2-[(2-Amino-2-oxoethyl)sulfanyl]-2-phenylbutanamide?
The molecular weight of 2-[(2-Amino-2-oxoethyl)sulfanyl]-2-phenylbutanamide is 252.09 g/mol.
Where can I buy 2-[(2-Amino-2-oxoethyl)sulfanyl]-2-phenylbutanamide?
You can request a quote for 2-[(2-Amino-2-oxoethyl)sulfanyl]-2-phenylbutanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(2-Amino-2-oxoethyl)sulfanyl]-2-phenylbutanamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2-Amino-2-oxoethyl)sulfanyl]-2-phenylbutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.