Chemical ID: 5875314

CCCCCN(C(CC)c1nc2ccccc2c(=O)n1c3ccc(cc3)F)C(=O)c4ccc(c(c4)[N+](=O)[O-])C
Chemical ID:
5875314
Name [?]:
N-[1-[3-(4-fluorophenyl)-4-oxo-quinazolin-2-yl]propyl]-4-methyl-3-nitro-N-pentyl-benzamide
SMILES [?]:
CCCCCN(C(CC)c1nc2ccccc2c(=O)n1c3ccc(cc3)F)C(=O)c4ccc(c(c4)[N+](=O)[O-])C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C30H31FN4O4
All Atoms:39
Heavy Atoms:39
Chiral Atoms:1
ZAP Information [?]
Total:9.75217
Area:738.627
Solvation:-8.71351
Coulombic:-58.0496
Bond Count [?]
All:42
Single:29
Double:13
Rotors:11
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:530.59
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:6.63
LogP (Chemaxon):6.65

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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