N-(9H-Fluoren-9-ylacetyl)-S-methylcysteine

HCID 128652

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Basic information

CAS: 85369-28-4
Standard SMILES: CSC[C@H](NC(=O)CC1c2ccccc2-c2ccccc21)C(=O)O
InChIKey: AYTUWLODZRLRAV-KRWDZBQOSA-N
Molecular formula: C19H19NO3S
Average molar mass: 341.4 g/mol
Monoisotopic mass: 341.10856447

Overview

structure given in first source

Names & identifiers

Preferred name: N-(9H-Fluoren-9-ylacetyl)-S-methylcysteine
IUPAC: (2R)-2-[[2-(9H-fluoren-9-yl)acetyl]amino]-3-methylsulfanylpropanoic acid
English name: N-(9H-fluoren-9-ylacetyl)-S-methylcysteine
Molecular formula: C19H19NO3S
Molecular weight: 341.42

Names & synonyms

A-336N-(9H-Fluoren-9-ylacetyl)-S-methylcysteine85369-28-4DTXSID80234543L-Cysteine, N-(9H-fluoren-9-ylacetyl)-S-methyl-RefChem:162290DTXCID10157034A 336AYTUWLODZRLRAV-KRWDZBQOSA-NN-[(9H-Fluoren-9-yl)acetyl]-S-methyl-L-cysteineL-Cysteine, N-(9H-fluoren-9-ylacetyl)-S-methyl- (9CI)(2R)-2-[[2-(9H-fluoren-9-yl)acetyl]amino]-3-methylsulfanylpropanoic acid

Database identifiers

CAS: 85369-28-4
PubChem CID: 128652
DTXSID: DTXSID80234543

Properties

Computed structural properties

XLogP: 2.9
Topological polar surface area: 91.7 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 4
Rotatable bonds: 6
Heavy atoms: 24
Formal charge: 0
Complexity: 448

Related reactions

2 records

New reaction record

HRID 1955946As reactantuspto-grants-1998_07

HRID 1955965As reactantuspto-grants-1998_07

Compound notes

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