Chemical ID: 3843195

CC(C(=O)Nc1cccc2c1cccc2)Sc3nnc(n3C)COc4ccc5ccccc5c4
Chemical ID:
3843195
Name [?]:
2-[[4-methyl-5-(2-naphthyloxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(1-naphthyl)propanamide
SMILES [?]:
CC(C(=O)Nc1cccc2c1cccc2)Sc3nnc(n3C)COc4ccc5ccccc5c4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C27H24N4O2S
All Atoms:34
Heavy Atoms:34
Chiral Atoms:1
ZAP Information [?]
Total:13.3421
Area:715.613
Solvation:-4.54826
Coulombic:-43.4554
Bond Count [?]
All:38
Single:25
Double:13
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:468.571
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:7.04
LogP (Chemaxon):5.33

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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