Chemical ID: 6455409

c1ccc2c(c1)c3c([nH]2)C(N(CC3)C(=O)c4ccc(cc4)Cl)c5ccc(cc5)Cl
Chemical ID:
6455409
Name [?]:
None
SMILES [?]:
c1ccc2c(c1)c3c([nH]2)C(N(CC3)C(=O)c4ccc(cc4)Cl)c5ccc(cc5)Cl
InChi [?]:
InChI=1/C24H18Cl2N2O/c25-17-9-5-15(6-10-17)23-22-20(19-3-1-2-4-21(19)27-22)13-14-28(23)24(29)16-7-11-18(26)12-8-16/h1-12,23,27H,13-14H2
InChi Info:
AuxInfo=1/0/N:1,2,6,3,24,28,17,21,25,27,18,20,13,12,23,16,26,19,5,7,4,8,10,14,29,22,9,11,15/E:(5,6)(7,8)(9,10)(11,12)/rA:29cCCCCCCCCNCNCCCOCCCCCCClCCCCCCCl/rB:s1;d2;s3;d4;d1s5;s5;d7;s4s8;s8;s10;s11;s7s12;s11;d14;s14;s16;d17;s18;d19;d16s20;s19;s10;s23;d24;s25;d26;d23s27;s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C24H18Cl2N2O
All Atoms:29
Heavy Atoms:29
Chiral Atoms:1
ZAP Information [?]
Total:12.56
Area:605.482
Solvation:-2.57699
Coulombic:-32.3908
Bond Count [?]
All:33
Single:22
Double:11
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:421.318
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:6.03
LogP (Chemaxon):6.0

Name Annotations

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Descriptor Annotations

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