Chemical ID: 5984334

CSc1ccc(cc1)NC(=O)N2CCCC2C(=O)Nc3nnc(s3)c4ccc(cc4)Cl
Chemical ID:
5984334
Name [?]:
N'-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]-N-(4-methylsulfanylphenyl)-pyrrolidine-1,2-dicarboxamide
SMILES [?]:
CSc1ccc(cc1)NC(=O)N2CCCC2C(=O)Nc3nnc(s3)c4ccc(cc4)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H20ClN5O2S2
All Atoms:31
Heavy Atoms:31
Chiral Atoms:1
ZAP Information [?]
Total:12.736
Area:707.366
Solvation:-4.94814
Coulombic:-56.5479
Bond Count [?]
All:34
Single:24
Double:10
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:474.001
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:4.96
LogP (Chemaxon):4.58

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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