Chemical ID: 4782344

CC(C)(C)NC(=S)NN=Cc1c[nH]nc1c2ccc(cc2)OC
Chemical ID:
4782344
Name [?]:
3-[[3-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyleneamino]-1-tert-butyl-thiourea
SMILES [?]:
CC(C)(C)NC(=S)NN=Cc1c[nH]nc1c2ccc(cc2)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H21N5OS
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:9.97156
Area:548.672
Solvation:-3.74525
Coulombic:-39.4203
Bond Count [?]
All:24
Single:17
Double:7
Rotors:7
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:331.437
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:4.56
LogP (Chemaxon):3.21

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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