Chemical ID: 6793524

Cc1ccc(cc1)c2c3c([nH]n2)OC(=C(C3c4ccc(c(c4)O)OC)C#N)N
Chemical ID:
6793524
Name [?]:
4-amino-2-(3-hydroxy-4-methoxy-phenyl)-9-(p-tolyl)-5-oxa-7,8-diazabicyclo[4.3.0]nona-3,8,10-triene-3-carbonitrile
SMILES [?]:
Cc1ccc(cc1)c2c3c([nH]n2)OC(=C(C3c4ccc(c(c4)O)OC)C#N)N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H18N4O3
All Atoms:46
Heavy Atoms:28
Chiral Atoms:1
ZAP Information [?]
Total:7.93432
Area:537.973
Solvation:-5.515
Coulombic:-61.1568
Bond Count [?]
All:31
Single:21
Double:9
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:374.393
H-Bond Donors:3
H-Bond Acceptors:5
XLogP:4.28
LogP (Chemaxon):3.52

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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