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Chemical ID: 7668331
Chemical ID:
7668331
Name [?]:
None
SMILES [?]:
CN(CCCNC(=O)Nc1cccc(c1)Cl)C(=O)Nc2cccc(c2)Cl
InChi [?]:
InChI=1/C18H20Cl2N4O2/c1-24(18(26)23-16-8-3-6-14(20)12-16)10-4-9-21-17(25)22-15-7-2-5-13(19)11-15/h2-3,5-8,11-12H,4,9-10H2,1H3,(H,23,26)(H2,21,22,25)
InChi Info:
AuxInfo=1/1/N:1,12,22,4,13,23,11,21,5,3,15,25,14,24,10,20,7,17,16,26,6,9,19,2,8,18/rA:26nCNCCCNCONCCCCCCClCONCCCCCCCl/rB:s1;s2;s3;s4;s5;s6;d7;s7;s9;s10;d11;s12;d13;d10s14;s14;s2;d17;s17;s19;s20;d21;s22;d23;d20s24;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C18H20Cl2N4O2 |
All Atoms: | 46 |
Heavy Atoms: | 26 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 12.9132 |
Area: | 641.257 |
Solvation: | -3.11822 |
Coulombic: | -66.0529 |
Bond Count [?]
All: | 27 |
Single: | 19 |
Double: | 8 |
Rotors: | 10 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 3.37 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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