N-(3-Nitratopivaloyl)cysteine ethyl ester
TL;DR: N-(3-Nitratopivaloyl)cysteine ethyl ester (CAS 130432-17-6) is a chemical compound with molecular formula C10H18N2O6S and molecular weight 294.08856 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl (2R)-2-[(2,2-dimethyl-3-nitrooxypropanoyl)amino]-3-sulfanylpropanoate
Also Known As: Spm 3672, N-(3-Nitratopivaloyl)cysteine ethyl ester, SP/W-3672, SW/P-3672, SID:53790270
Technical Specifications
| Molecular Formula | C10H18N2O6S |
| Molecular Weight | 294.08856 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 111.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 294.08856 Da |
| Heavy Atoms | 19 |
| Complexity | 341.0 |
| SMILES | CCOC(=O)[C@H](CS)NC(=O)C(C)(C)CO[N+](=O)[O-] |
| InChIKey | KCKXBNDUEKMBFJ-ZETCQYMHSA-N |
Chemical Property Profile of N-(3-Nitratopivaloyl)cysteine ethyl ester
Property Insights of N-(3-Nitratopivaloyl)cysteine ethyl ester
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-Nitratopivaloyl)cysteine ethyl ester. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-Nitratopivaloyl)cysteine ethyl ester. Following Lipinski's Rule of Five, N-(3-Nitratopivaloyl)cysteine ethyl ester has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(3-Nitratopivaloyl)cysteine ethyl ester?
The CAS number of N-(3-Nitratopivaloyl)cysteine ethyl ester is 130432-17-6.
What is the molecular formula of N-(3-Nitratopivaloyl)cysteine ethyl ester?
The molecular formula of N-(3-Nitratopivaloyl)cysteine ethyl ester is C10H18N2O6S.
What is the molecular weight of N-(3-Nitratopivaloyl)cysteine ethyl ester?
The molecular weight of N-(3-Nitratopivaloyl)cysteine ethyl ester is 294.08856 g/mol.
Where can I buy N-(3-Nitratopivaloyl)cysteine ethyl ester?
You can request a quote for N-(3-Nitratopivaloyl)cysteine ethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(3-Nitratopivaloyl)cysteine ethyl ester?
Yes, CoreyChem provides custom synthesis services for N-(3-Nitratopivaloyl)cysteine ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.