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Chemical ID: 7698287
Chemical ID:
7698287
Name [?]:
None
SMILES [?]:
CN(Cc1ccccc1)C(=O)C2CCCN(C2)Cc3ccccc3Cl
InChi [?]:
InChI=1/C21H25ClN2O/c1-23(14-17-8-3-2-4-9-17)21(25)19-11-7-13-24(16-19)15-18-10-5-6-12-20(18)22/h2-6,8-10,12,19H,7,11,13-16H2,1H3
InChi Info:
AuxInfo=1/0/N:1,7,6,8,21,22,14,5,9,20,13,23,15,3,18,17,4,19,12,24,10,25,2,16,11/E:(3,4)(8,9)/rA:25cCNCCCCCCCCOCCCCNCCCCCCCCCl/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s2;d10;s10;s12;s13;s14;s15;s12s16;s16;s18;s19;d20;s21;d22;d19s23;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C21H25ClN2O |
All Atoms: | 50 |
Heavy Atoms: | 25 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 11.3532 |
Area: | 565.647 |
Solvation: | -2.78797 |
Coulombic: | -24.3217 |
Bond Count [?]
All: | 27 |
Single: | 20 |
Double: | 7 |
Rotors: | 6 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 3.95 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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