1-[(6-Chloronaphthalen-2-yl)sulfonyl]-3-methoxycarbonylmethylpiperazine

HCID 22709489

Basic information

Standard SMILES
COC(=O)CC1CN(S(=O)(=O)c2ccc3cc(Cl)ccc3c2)CCN1
InChIKey
AJAPHNXAQMOVRV-UHFFFAOYSA-N
Molecular formula
C17H19ClN2O4S
Average molar mass
382.9 g/mol
Monoisotopic mass
382.075406

Names & identifiers

Preferred name
1-[(6-Chloronaphthalen-2-yl)sulfonyl]-3-methoxycarbonylmethylpiperazine
IUPAC
methyl 2-[4-(6-chloronaphthalen-2-yl)sulfonylpiperazin-2-yl]acetate

Names & synonyms

SCHEMBL6198614AJAPHNXAQMOVRV-UHFFFAOYSA-N1-[(6-chloronaphthalen-2-yl)sulfonyl]-3-[methoxycarbonylmethyl]piperazine1-[(6-chloronaphthalen-2-yl)sulfonyl]-3-methoxycarbonylmethylpiperazine

Database identifiers

PubChem CID
22709489

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
84.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
25

Related reactions

5 records

Compound notes

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