Chemical ID: 6004377

CCCCc1ccc(cc1)C(=O)NC(C)C(=O)Nc2nnc(s2)c3cccc(c3)C
Chemical ID:
6004377
Name [?]:
4-butyl-N-[1-[[5-(m-tolyl)-1,3,4-thiadiazol-2-yl]carbamoyl]ethyl]benzamide
SMILES [?]:
CCCCc1ccc(cc1)C(=O)NC(C)C(=O)Nc2nnc(s2)c3cccc(c3)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H26N4O2S
All Atoms:30
Heavy Atoms:30
Chiral Atoms:1
ZAP Information [?]
Total:14.12
Area:701.015
Solvation:-3.40536
Coulombic:-50.3734
Bond Count [?]
All:32
Single:22
Double:10
Rotors:10
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:422.544
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:6.35
LogP (Chemaxon):4.9

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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