Chemical ID: 5930651

Cc1ccn2c(c1)nc(c2NC(C)(C)CC(C)(C)C)c3ccccc3OC(=O)Cc4ccccc4
Chemical ID:
5930651
Name [?]:
[2-[4-methyl-9-(1,1,3,3-tetramethylbutylamino)-1,7-diazabicyclo[4.3.0]nona-2,4,6,8-tetraen-8-yl]phenyl] 2-phenylacetate
SMILES [?]:
Cc1ccn2c(c1)nc(c2NC(C)(C)CC(C)(C)C)c3ccccc3OC(=O)Cc4ccccc4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C30H35N3O2
All Atoms:35
Heavy Atoms:35
Chiral Atoms:0
ZAP Information [?]
Total:14.0255
Area:676.491
Solvation:-2.88673
Coulombic:-45.4107
Bond Count [?]
All:38
Single:27
Double:11
Rotors:9
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:469.618
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:8.09
LogP (Chemaxon):7.21

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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