Chemical ID: 3928616

CC(C)CN(c1nnc(s1)c2ccc(cc2)C(C)(C)C)C(=O)CCc3ccccc3OC
Chemical ID:
3928616
Name [?]:
N-isobutyl-3-(2-methoxyphenyl)-N-[5-(4-tert-butylphenyl)-1,3,4-thiadiazol-2-yl]-propanamide
SMILES [?]:
CC(C)CN(c1nnc(s1)c2ccc(cc2)C(C)(C)C)C(=O)CCc3ccccc3OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C26H33N3O2S
All Atoms:32
Heavy Atoms:32
Chiral Atoms:0
ZAP Information [?]
Total:14.4209
Area:712.54
Solvation:-3.39256
Coulombic:-32.3021
Bond Count [?]
All:34
Single:25
Double:9
Rotors:10
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:451.625
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:7.11
LogP (Chemaxon):6.19

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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