ChemDB: Chemical Search
Download
Chemical ID: 7703998
Chemical ID:
7703998
Name [?]:
None
SMILES [?]:
Cc1ccc(cc1C)OCC(=O)NN=Cc2cccc(c2)OC(=O)c3ccc(cc3Cl)Cl
InChi [?]:
InChI=1/C24H20Cl2N2O4/c1-15-6-8-19(10-16(15)2)31-14-23(29)28-27-13-17-4-3-5-20(11-17)32-24(30)21-9-7-18(25)12-22(21)26/h3-13H,14H2,1-2H3,(H,28,29)
InChi Info:
AuxInfo=1/1/N:1,8,18,17,19,3,27,4,26,6,21,29,15,10,2,7,16,28,5,20,25,30,11,23,32,31,14,13,12,24,9,22/rA:32nCCCCCCCCOCCONNCCCCCCCOCOCCCCCCClCl/rB:s1;s2;d3;s4;d5;d2s6;s7;s5;s9;s10;d11;s11;s13;w14;s15;s16;d17;s18;d19;d16s20;s20;s22;d23;s23;s25;d26;s27;d28;d25s29;s30;s28;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C24H20Cl2N2O4 |
All Atoms: | 52 |
Heavy Atoms: | 32 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 11.8026 |
Area: | 738.117 |
Solvation: | -6.65036 |
Coulombic: | -46.049 |
Bond Count [?]
All: | 34 |
Single: | 22 |
Double: | 12 |
Rotors: | 9 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 7.3 |
LogP (Chemaxon): | None |
Name Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical | Mix Source | External ID | Descriptor | Value |
---|
Experimental Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
---|
Descriptor Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
---|