(S)-(1-(2-chlorobenzylcarbamoyl)pyrrolidin-2-yl)methyl 4-ethylphenylcarbamate

HCID 59778442
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Basic information

Standard SMILES
CCc1ccc(NC(=O)OC[C@@H]2CCCN2C(=O)NCc2ccccc2Cl)cc1
InChIKey
LTBDPLAADHMYNW-IBGZPJMESA-N
Molecular formula
C22H26ClN3O3
Average molar mass
415.9 g/mol

Names & identifiers

Preferred name
(S)-(1-(2-chlorobenzylcarbamoyl)pyrrolidin-2-yl)methyl 4-ethylphenylcarbamate
IUPAC
[(2S)-1-[(2-chlorophenyl)methylcarbamoyl]pyrrolidin-2-yl]methyl N-(4-ethylphenyl)carbamate

Names & synonyms

SCHEMBL4794378LTBDPLAADHMYNW-IBGZPJMESA-N(S)-(1-(2-chlorobenzylcarbamoyl)pyrrolidin-2-yl)methyl 4-ethylphenylcarbamate

Database identifiers

PubChem CID
59778442

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
70.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
7
Heavy atoms
29

Related reactions

1 records
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Compound notes

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