N-tert-Butyloxycarbonyl-S-benzylcysteine
TL;DR: N-tert-Butyloxycarbonyl-S-benzylcysteine (CAS 102830-49-9) is a chemical compound with molecular formula C15H21NO4S and molecular weight 311.11914 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-3-benzylsulfanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
Also Known As: N-Boc-S-benzyl-D-cysteine, Boc-D-Cys(Bzl)-OH, Boc-S-benzyl-D-cysteine, Boc-Cys(Bzl)-OH, Boc-S-Benzyl-D-Cys
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C15H21NO4S |
| Molecular Weight | 311.11914 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 311.11914 Da |
| Heavy Atoms | 21 |
| Complexity | 348.0 |
| SMILES | CC(C)(C)OC(=O)N[C@H](CSCC1=CC=CC=C1)C(=O)O |
| InChIKey | IFVORPLRHYROAA-GFCCVEGCSA-N |
Chemical Property Profile of N-tert-Butyloxycarbonyl-S-benzylcysteine
Property Insights of N-tert-Butyloxycarbonyl-S-benzylcysteine
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-tert-Butyloxycarbonyl-S-benzylcysteine. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-tert-Butyloxycarbonyl-S-benzylcysteine. Following Lipinski's Rule of Five, N-tert-Butyloxycarbonyl-S-benzylcysteine 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
What is the CAS number of N-tert-Butyloxycarbonyl-S-benzylcysteine?
The CAS number of N-tert-Butyloxycarbonyl-S-benzylcysteine is 102830-49-9.
What is the molecular formula of N-tert-Butyloxycarbonyl-S-benzylcysteine?
The molecular formula of N-tert-Butyloxycarbonyl-S-benzylcysteine is C15H21NO4S.
What is the molecular weight of N-tert-Butyloxycarbonyl-S-benzylcysteine?
The molecular weight of N-tert-Butyloxycarbonyl-S-benzylcysteine is 311.11914 g/mol.
Where can I buy N-tert-Butyloxycarbonyl-S-benzylcysteine?
You can request a quote for N-tert-Butyloxycarbonyl-S-benzylcysteine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-tert-Butyloxycarbonyl-S-benzylcysteine?
Yes, CoreyChem provides custom synthesis services for N-tert-Butyloxycarbonyl-S-benzylcysteine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.