Chemical ID: 5367791

c1cc(c(cc1C(=O)OCC(=O)N(C2CCCCC2)C3CCCCC3)[N+](=O)[O-])N
Chemical ID:
5367791
Name [?]:
dicyclohexylcarbamoylmethyl 4-amino-3-nitro-benzoate
SMILES [?]:
c1cc(c(cc1C(=O)OCC(=O)N(C2CCCCC2)C3CCCCC3)[N+](=O)[O-])N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H29N3O5
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:7.5586
Area:622.294
Solvation:-7.99876
Coulombic:-65.8082
Bond Count [?]
All:31
Single:25
Double:6
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:403.472
H-Bond Donors:2
H-Bond Acceptors:8
XLogP:4.52
LogP (Chemaxon):3.75

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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