Chemical ID: 4555701

CC1Cc2c3ccccc3[nH]c2C4N1C(=O)C5C4CC=CC5
Chemical ID:
4555701
Name [?]:
None
SMILES [?]:
CC1Cc2c3ccccc3[nH]c2C4N1C(=O)C5C4CC=CC5
InChi [?]:
InChI=1/C19H20N2O/c1-11-10-15-12-6-4-5-9-16(12)20-17(15)18-13-7-2-3-8-14(13)19(22)21(11)18/h2-6,9,11,13-14,18,20H,7-8,10H2,1H3
InChi Info:
AuxInfo=1/0/N:1,20,21,7,8,6,19,22,9,3,2,5,18,17,4,10,12,13,15,11,14,16/rA:22cCCCCCCCCCCNCCNCOCCCCCC/rB:s1;s2;s3;s4;s5;d6;s7;d8;d5s9;s10;d4s11;s12;s2s13;s14;d15;s15;s13s17;s18;s19;d20;s17s21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H20N2O
All Atoms:22
Heavy Atoms:22
Chiral Atoms:4
ZAP Information [?]
Total:9.23095
Area:454.6
Solvation:-2.13405
Coulombic:-28.9219
Bond Count [?]
All:26
Single:20
Double:6
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:292.375
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.9
LogP (Chemaxon):3.0

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