Chemical ID: 4272889

Cc1c2c(n(n1)c3ccccc3)OC(=C(C2c4cc(c(c(c4)OC)OC)OC)C#N)N
Chemical ID:
4272889
Name [?]:
4-amino-9-methyl-7-phenyl-2-(3,4,5-trimethoxyphenyl)-5-oxa-7,8-diazabicyclo[4.3.0]nona-3,8,10-triene-3-carbonitrile
SMILES [?]:
Cc1c2c(n(n1)c3ccccc3)OC(=C(C2c4cc(c(c(c4)OC)OC)OC)C#N)N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H22N4O4
All Atoms:31
Heavy Atoms:31
Chiral Atoms:1
ZAP Information [?]
Total:7.83925
Area:617.06
Solvation:-7.58725
Coulombic:-53.8842
Bond Count [?]
All:34
Single:24
Double:9
Rotors:5
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:418.445
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:3.33
LogP (Chemaxon):2.55

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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