Chemical ID: 3873675

CC(C)(C)Nc1c(nc2n1cccc2)c3ccc(c(c3)O)OC
Chemical ID:
3873675
Name [?]:
2-methoxy-5-(7-tert-butylamino-6,9-diazabicyclo[4.3.0]nona-2,4,7,9-tetraen-8-yl)-phenol
SMILES [?]:
CC(C)(C)Nc1c(nc2n1cccc2)c3ccc(c(c3)O)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H21N3O2
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:7.99223
Area:487.231
Solvation:-4.18854
Coulombic:-47.2644
Bond Count [?]
All:25
Single:18
Double:7
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:311.378
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:3.89
LogP (Chemaxon):3.24

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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