Chemical ID: 7351200

COc1ccccc1C(=O)N2CCc3c(c4ccccc4[nH]3)C2
Chemical ID:
7351200
Name [?]:
None
SMILES [?]:
COc1ccccc1C(=O)N2CCc3c(c4ccccc4[nH]3)C2
InChi [?]:
InChI=1/C19H18N2O2/c1-23-18-9-5-3-7-14(18)19(22)21-11-10-17-15(12-21)13-6-2-4-8-16(13)20-17/h2-9,20H,10-12H2,1H3
InChi Info:
AuxInfo=1/0/N:1,18,6,19,5,17,7,20,4,13,12,23,16,8,15,21,14,3,9,22,11,10,2/rA:23nCOCCCCCCCONCCCCCCCCCCNC/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;d9;s9;s11;s12;s13;d14;s15;s16;d17;s18;d19;d16s20;s14s21;s11s15;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H18N2O2
All Atoms:41
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:8.02567
Area:489.028
Solvation:-4.20003
Coulombic:-35.7609
Bond Count [?]
All:26
Single:18
Double:8
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:306.358
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:3.12
LogP (Chemaxon):2.66

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