2-[[4-(4-chlorophenoxy)phenyl]carbamothioylamino]-3-phenyl-N-(2-pyrrolidin-1-ylethyl)propanamide

HCID 72441069
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Basic information

Standard SMILES
O=C(NCCN1CCCC1)C(Cc1ccccc1)NC(=S)Nc1ccc(Oc2ccc(Cl)cc2)cc1
InChIKey
IVXDTOLICPPPGJ-UHFFFAOYSA-N
Molecular formula
C28H31ClN4O2S
Average molar mass
523.1 g/mol

Names & identifiers

Preferred name
2-[[4-(4-chlorophenoxy)phenyl]carbamothioylamino]-3-phenyl-N-(2-pyrrolidin-1-ylethyl)propanamide
IUPAC
2-[[4-(4-chlorophenoxy)phenyl]carbamothioylamino]-3-phenyl-N-(2-pyrrolidin-1-ylethyl)propanamide

Names & synonyms

SCHEMBL5404674

Database identifiers

PubChem CID
72441069

Properties

Computed structural properties

XLogP
5.5
Topological polar surface area
97.7 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
4
Rotatable bonds
10
Heavy atoms
36

Related reactions

2 records
New reaction record

Linked notes

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