Basic information
- CAS
2364-87-6- Standard SMILES
Cc1ccc(S(=O)(=O)N[C@@H](CCCCN)C(=O)CCl)cc1- InChIKey
RDFCSSHDJSZMTQ-ZDUSSCGKSA-N- Molecular formula
- C14H21ClN2O3S
- Average molar mass
- 332.8 g/mol
- Monoisotopic mass
- 332.0961414
Overview
Tos-Lys-CH2Cl is a sulfonic acid derivative.
Names & identifiers
- Preferred name
- N-((1S)-5-amino-1-(chloroacetyl)pentyl)-4-methylbenzenesulfonamide
- IUPAC
- N-[(3S)-7-amino-1-chloro-2-oxoheptan-3-yl]-4-methylbenzenesulfonamide
- English name
- TLCK
- Molecular formula
- C14H21ClN2O3S
- Molecular weight
- 332.85
Names & synonyms
N-[(1s)-5-Amino-1-(Chloroacetyl)pentyl]-4-MethylbenzenesulfonamideN-((1S)-5-amino-1-(chloroacetyl)pentyl)-4-methylbenzenesulfonamideRefChem:822822TLCKTosyl-L-lysine chloromethyl ketoneTos-Lys-CH2Cl2364-87-6Tosyllysyl chloromethyl ketonealpha-Tosyl-L-lysylchloromethyl ketonen-[(3s)-7-amino-1-chloro-2-oxoheptan-3-yl]-4-methylbenzenesulfonamideBRN 2885388CHEMBL466465
Show more names
TLCK HCLTOS-LYS-CMK HCLTLCK HYDROCHLORIDETOS-LYS-CHLOROMETHYLKETONE HCLTOSYL-L-LYSYL-CHLOROMETHANE HCLTOSYL-L-LYSINE CHLOROMETHYLKETONE HCLN-p-Tosyl-L-lysyl chloromethyl ketone
N-alpha-Tosyl-L-lysyl-chloromethylketoneN-alpha-p-Tosyl-L-lysine chloromethyl ketoneTosyl-Lys-CMKp-Toluenesulfonamide, N-(5-amino-1-(chloroacetyl)pentyl)-, L-Tosyl-K-CMKN-[(1S)-5-amino-1-(2-chloroacetyl)pentyl]-4-methyl-benzenesulfonamidep-Toluenesulfonamide, N-[5-amino-1-(chloroacetyl)pentyl]-, L-N-Tosyl-L-lysine chloromethyl ketone
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 97.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 414
Experimental & physicochemical properties
DrugsPharmaceuticals -> Listed in ZINC15
Physicochemical properties
- Melting point
- 165 °C · ~165 °C (dec.)
- Boiling point
- 144 °C · 144°C (rough estimate)
- Density
- 1.1784 · 1.1784 (rough estimate)
- refractive index
- 1.563 · 1.5630 (estimate)
- storage temp.
- 2 · 2-8°C
- solubility
- 2 O: · H2O: 50 mg/mL
- form
- powder
- pka
- 8.52 · 8.52±0.50(Predicted)
- color
- white to pink
- CAS DataBase Reference
- 2364 · 2364-87-6(CAS DataBase Reference)
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- F
- 10-21
- wgk
- 3
- rtecs
- XT5160000
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36
Chemistry & industry
Suppliers4 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
雷丁试剂0510-85629785 18013409632 · [email protected]
厦门盈融达化工有限公司+86-0592-6210733 · [email protected]
吉尔生化(上海)有限公司21-61263452 13641803416 · [email protected]
Additional notes
DefinitionChEBI: Tos-Lys-CH2Cl is a sulfonic acid derivative.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…