Chemical ID: 6883476

Cc1ccc2c(c1)c(=NC3CCCCC3C)cc(o2)c4ccc(c(c4)OC)OC
Chemical ID:
6883476
Name [?]:
2-(3,4-dimethoxyphenyl)-6-methyl-N-(2-methylcyclohexyl)-chromen-4-imine
SMILES [?]:
Cc1ccc2c(c1)c(=NC3CCCCC3C)cc(o2)c4ccc(c(c4)OC)OC
InChi [?]:
InChI=1/C25H29NO3/c1-16-9-11-22-19(13-16)21(26-20-8-6-5-7-17(20)2)15-24(29-22)18-10-12-23(27-3)25(14-18)28-4/h9-15,17,20H,5-8H2,1-4H3
InChi Info:
AuxInfo=1/0/N:1,16,29,27,13,12,14,11,3,21,4,22,7,25,17,2,15,20,6,10,8,5,23,18,24,9,28,26,19/rA:29cCCCCCCCCNCCCCCCCCCOCCCCCCOCOC/rB:s1;s2;d3;s4;d5;d2s6;s6;w8;s9;s10;s11;s12;s13;s10s14;s15;s8;d17;s5s18;s18;s20;d21;s22;d23;d20s24;s24;s26;s23;s28;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C25H29NO3
All Atoms:58
Heavy Atoms:29
Chiral Atoms:2
ZAP Information [?]
Total:10.1312
Area:617.477
Solvation:-5.30574
Coulombic:-29.417
Bond Count [?]
All:32
Single:24
Double:8
Rotors:4
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:391.503
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:6.03
LogP (Chemaxon):5.99

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Descriptor Annotations

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