Chemical ID: 7278305

c1ccc2cc(ccc2c1)C(=O)NC3CCCc4c3cccc4
Chemical ID:
7278305
Name [?]:
N-tetralin-1-ylnaphthalene-2-carboxamide
SMILES [?]:
c1ccc2cc(ccc2c1)C(=O)NC3CCCc4c3cccc4
InChi [?]:
InChI=1/C21H19NO/c23-21(18-13-12-15-6-1-2-8-17(15)14-18)22-20-11-5-9-16-7-3-4-10-19(16)20/h1-4,6-8,10,12-14,20H,5,9,11H2,(H,22,23)
InChi Info:
AuxInfo=1/1/N:1,2,22,21,16,10,23,3,17,20,15,8,7,5,9,18,4,6,19,14,11,13,12/rA:23cCCCCCCCCCCCONCCCCCCCCCC/rB:s1;d2;s3;s4;d5;s6;d7;d4s8;d1s9;s6;d11;s11;s13;s14;s15;s16;s17;s14s18;d19;s20;d21;d18s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H19NO
All Atoms:42
Heavy Atoms:23
Chiral Atoms:1
ZAP Information [?]
Total:10.543
Area:497.616
Solvation:-1.8974
Coulombic:-25.8771
Bond Count [?]
All:26
Single:17
Double:9
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:301.382
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:5.28
LogP (Chemaxon):4.57

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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