Chemical ID: 5394136

CCn1c(nnc1SCC(=O)Nc2ccccc2)C(CCSC)NC(=O)c3ccc(cc3)OC
Chemical ID:
5394136
Name [?]:
N-[1-[4-ethyl-5-(phenylcarbamoylmethylsulfanyl)-1,2,4-triazol-3-yl]-3-methylsulfanyl-propyl]-4-methoxy-benzamide
SMILES [?]:
CCn1c(nnc1SCC(=O)Nc2ccccc2)C(CCSC)NC(=O)c3ccc(cc3)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H29N5O3S2
All Atoms:34
Heavy Atoms:34
Chiral Atoms:1
ZAP Information [?]
Total:14.275
Area:781.141
Solvation:-5.25348
Coulombic:-63.3823
Bond Count [?]
All:36
Single:26
Double:10
Rotors:14
Chiral:0
Rigid Segments:11
Chemical Properties
Molecular Weight:499.651
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:5.54
LogP (Chemaxon):3.09

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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