Chemical ID: 6836211

c1ccc2c(c1)ccc3c2[nH]cc(c3=O)C(=O)Nc4cccc(c4)Cl
Chemical ID:
6836211
Name [?]:
None
SMILES [?]:
c1ccc2c(c1)ccc3c2[nH]cc(c3=O)C(=O)Nc4cccc(c4)Cl
InChi [?]:
InChI=1/C20H13ClN2O2/c21-13-5-3-6-14(10-13)23-20(25)17-11-22-18-15-7-2-1-4-12(15)8-9-16(18)19(17)24/h1-11H,(H,22,24)(H,23,25)
InChi Info:
AuxInfo=1/1/N:1,2,21,6,22,20,3,7,8,24,12,5,23,19,4,9,13,10,14,16,25,11,18,15,17/rA:25nCCCCCCCCCCNCCCOCONCCCCCCCl/rB:s1;d2;s3;s4;d1s5;d5;s7;d8;d4s9;s10;s11;d12;s9s13;d14;s13;d16;s16;s18;s19;d20;s21;d22;d19s23;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H13ClN2O2
All Atoms:38
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:9.77541
Area:536.405
Solvation:-3.63473
Coulombic:-41.8012
Bond Count [?]
All:28
Single:17
Double:11
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:348.782
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.57
LogP (Chemaxon):4.57

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