Chemical ID: 6332200

Cc1c(cccc1Cl)N2C(=O)C3C4CC(C3C2=O)C=C4
Chemical ID:
6332200
Name [?]:
None
SMILES [?]:
Cc1c(cccc1Cl)N2C(=O)C3C4CC(C3C2=O)C=C4
InChi [?]:
InChI=1/C16H14ClNO2/c1-8-11(17)3-2-4-12(8)18-15(19)13-9-5-6-10(7-9)14(13)16(18)20/h2-6,9-10,13-14H,7H2,1H3
InChi Info:
AuxInfo=1/0/N:1,5,6,4,19,20,14,2,15,13,7,3,16,12,17,10,8,9,18,11/E:(5,6)(9,10)(13,14)(15,16)(19,20)/rA:20cCCCCCCCClNCOCCCCCCOCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s3;s9;d10;s10;s12;s13;s14;s12s15;s9s16;d17;s15;s13d19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H14ClNO2
All Atoms:20
Heavy Atoms:20
Chiral Atoms:4
ZAP Information [?]
Total:8.4279
Area:439.049
Solvation:-2.54834
Coulombic:-25.3606
Bond Count [?]
All:23
Single:17
Double:6
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:287.741
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:2.55
LogP (Chemaxon):2.75

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