Chemical ID: 5327361

CCCn1c(c(c2c1cccc2)C(=O)c3cccc4c3cccc4)C
Chemical ID:
5327361
Name [?]:
(2-methyl-1-propyl-indol-3-yl)-(1-naphthyl)methanone
SMILES [?]:
CCCn1c(c(c2c1cccc2)C(=O)c3cccc4c3cccc4)C
InChi [?]:
InChI=1/C23H21NO/c1-3-15-24-16(2)22(20-12-6-7-14-21(20)24)23(25)19-13-8-10-17-9-4-5-11-18(17)19/h4-14H,3,15H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,25,2,23,22,11,10,17,24,18,21,12,16,9,3,5,19,20,15,7,8,6,13,4,14/rA:25nCCCNCCCCCCCCCOCCCCCCCCCCC/rB:s1;s2;s3;s4;d5;s6;s4s7;d8;s9;d10;d7s11;s6;d13;s13;s15;d16;s17;d18;d15s19;s20;d21;s22;s19d23;s5;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C23H21NO
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:11.5105
Area:537.208
Solvation:-1.91973
Coulombic:-18.6143
Bond Count [?]
All:28
Single:18
Double:10
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:327.419
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:6.23
LogP (Chemaxon):5.74

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue