Chemical ID: 4475264

CCc1ccc(cc1)NC(=O)CSc2nnc(n2CC=C)CNC(=O)c3ccc(cc3)OC
Chemical ID:
4475264
Name [?]:
N-[[4-allyl-5-[(4-ethylphenyl)carbamoylmethylsulfanyl]-1,2,4-triazol-3-yl]methyl]-4-methoxy-benzamide
SMILES [?]:
CCc1ccc(cc1)NC(=O)CSc2nnc(n2CC=C)CNC(=O)c3ccc(cc3)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H27N5O3S
All Atoms:33
Heavy Atoms:33
Chiral Atoms:0
ZAP Information [?]
Total:13.3468
Area:745.239
Solvation:-5.28421
Coulombic:-63.1115
Bond Count [?]
All:35
Single:24
Double:11
Rotors:13
Chiral:0
Rigid Segments:10
Chemical Properties
Molecular Weight:465.569
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:5.13
LogP (Chemaxon):3.29

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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