Chemical ID: 6656627

CC1(Cc2c(cc(n2Cc3ccc(cc3)Cl)c4ccccc4)C(=O)C1)C
Chemical ID:
6656627
Name [?]:
1-[(4-chlorophenyl)methyl]-6,6-dimethyl-2-phenyl-5,7-dihydroindol-4-one
SMILES [?]:
CC1(Cc2c(cc(n2Cc3ccc(cc3)Cl)c4ccccc4)C(=O)C1)C
InChi [?]:
InChI=1/C23H22ClNO/c1-23(2)13-21-19(22(26)14-23)12-20(17-6-4-3-5-7-17)25(21)15-16-8-10-18(24)11-9-16/h3-12H,13-15H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,26,20,19,21,18,22,11,15,12,14,6,3,25,9,10,17,13,5,7,4,23,2,16,8,24/E:(1,2)(4,5)(6,7)(8,9)(10,11)/rA:26nCCCCCCCNCCCCCCCClCCCCCCCOCC/rB:s1;s2;s3;d4;s5;d6;s4s7;s8;s9;s10;d11;s12;d13;d10s14;s13;s7;s17;d18;s19;d20;d17s21;s5;d23;s2s23;s2;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C23H22ClNO
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:11.4268
Area:553.614
Solvation:-2.41351
Coulombic:-17.417
Bond Count [?]
All:29
Single:20
Double:9
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:363.88
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:6.32
LogP (Chemaxon):5.33

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