Chemical ID: 6325342

CCCNC(=O)c1cc2n(n1)C(CC(N2)c3ccc(cc3)C)C(F)(F)F
Chemical ID:
6325342
Name [?]:
N-propyl-3-(p-tolyl)-5-(trifluoromethyl)-2,6,7-triazabicyclo[4.3.0]nona-7,9-diene-8-carboxamide
SMILES [?]:
CCCNC(=O)c1cc2n(n1)C(CC(N2)c3ccc(cc3)C)C(F)(F)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H21F3N4O
All Atoms:26
Heavy Atoms:26
Chiral Atoms:2
ZAP Information [?]
Total:10.8478
Area:567.493
Solvation:-3.33951
Coulombic:-58.6293
Bond Count [?]
All:28
Single:22
Double:6
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:366.381
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:4.7
LogP (Chemaxon):3.18

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Experimental Annotations

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Descriptor Annotations

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