Boc-D-pen(acm)-OH
TL;DR: Boc-D-pen(acm)-OH (CAS 129972-45-8) is a chemical compound with molecular formula C13H24N2O5S and molecular weight 320.1406 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-3-(acetamidomethylsulfanyl)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid
Also Known As: BOC-D-PEN(ACM)-OH, Boc-S-acetamidomethyl-D-penicillamine, 6795AD, Boc-S-acetamidomethyl-L-penicillamine, K-5897
Technical Specifications
| Molecular Formula | C13H24N2O5S |
| Molecular Weight | 320.1406 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 130.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 320.1406 Da |
| Heavy Atoms | 21 |
| Complexity | 404.0 |
| SMILES | CC(=O)NCSC(C)(C)[C@H](C(=O)O)NC(=O)OC(C)(C)C |
| InChIKey | SUSPMXBDNAADFK-VIFPVBQESA-N |
Chemical Property Profile of Boc-D-pen(acm)-OH
Property Insights of Boc-D-pen(acm)-OH
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Boc-D-pen(acm)-OH. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Boc-D-pen(acm)-OH. Following Lipinski's Rule of Five, Boc-D-pen(acm)-OH has 3 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 Boc-D-pen(acm)-OH?
The CAS number of Boc-D-pen(acm)-OH is 129972-45-8.
What is the molecular formula of Boc-D-pen(acm)-OH?
The molecular formula of Boc-D-pen(acm)-OH is C13H24N2O5S.
What is the molecular weight of Boc-D-pen(acm)-OH?
The molecular weight of Boc-D-pen(acm)-OH is 320.1406 g/mol.
Where can I buy Boc-D-pen(acm)-OH?
You can request a quote for Boc-D-pen(acm)-OH directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Boc-D-pen(acm)-OH?
Yes, CoreyChem provides custom synthesis services for Boc-D-pen(acm)-OH and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.