12P-128
TL;DR: 12P-128 (CAS 1396996-67-0) is a chemical compound with molecular formula C13H24BrNO5S and molecular weight 385.05585 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 3-(3-bromo-2-hydroxypropyl)sulfanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate
Also Known As: 12P-128, ethyl 3-[(3-bromo-2-hydroxypropyl)sulfanyl]-2-[(tert-butoxycarbonyl)amino]propanoate, ethyl 3-(3-bromo-2-hydroxypropyl)sulfanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate, ethyl 3-[(3-bromo-2-hydroxypropyl)sulfanyl]-2-{[(tert-butoxy)carbonyl]amino}propanoate, ethyl3-[(3-bromo-2-hydroxypropyl)sulfanyl]-2-{[(tert-butoxy)carbonyl]amino}propanoate
Technical Specifications
| Molecular Formula | C13H24BrNO5S |
| Molecular Weight | 385.05585 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 110.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 385.05585 Da |
| Heavy Atoms | 21 |
| Complexity | 335.0 |
| SMILES | CCOC(=O)C(CSCC(CBr)O)NC(=O)OC(C)(C)C |
| InChIKey | GNQDJWAKAYIOFN-UHFFFAOYSA-N |
Chemical Property Profile of 12P-128
Property Insights of 12P-128
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 12P-128. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 12P-128. Following Lipinski's Rule of Five, 12P-128 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 12P-128?
The CAS number of 12P-128 is 1396996-67-0.
What is the molecular formula of 12P-128?
The molecular formula of 12P-128 is C13H24BrNO5S.
What is the molecular weight of 12P-128?
The molecular weight of 12P-128 is 385.05585 g/mol.
Where can I buy 12P-128?
You can request a quote for 12P-128 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 12P-128?
Yes, CoreyChem provides custom synthesis services for 12P-128 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.