Chemical ID: 4797179

CN1c2ccccc2C3(C1=O)c4c(=O)c5ccccc5oc4C(=O)N3CCCOC
Chemical ID:
4797179
Name [?]:
None
SMILES [?]:
CN1c2ccccc2C3(C1=O)c4c(=O)c5ccccc5oc4C(=O)N3CCCOC
InChi [?]:
InChI=1/C23H20N2O5/c1-24-16-10-5-4-9-15(16)23(22(24)28)18-19(26)14-8-3-6-11-17(14)30-20(18)21(27)25(23)12-7-13-29-2/h3-6,8-11H,7,12-13H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,30,17,6,5,18,27,16,7,4,19,26,28,15,8,3,20,12,13,22,23,10,9,2,25,14,24,11,29,21/rA:30cCNCCCCCCCCOCCOCCCCCCOCCONCCCOC/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s2s9;d10;s9;s12;d13;s13;s15;d16;s17;d18;d15s19;s20;d12s21;s22;d23;s9s23;s25;s26;s27;s28;s29;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C23H20N2O5
All Atoms:30
Heavy Atoms:30
Chiral Atoms:1
ZAP Information [?]
Total:9.40998
Area:594.527
Solvation:-5.45319
Coulombic:-59.2102
Bond Count [?]
All:34
Single:24
Double:10
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:404.415
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:1.7
LogP (Chemaxon):1.35

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Descriptor Annotations

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