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Chemical ID: 7659892
Chemical ID:
7659892
Name [?]:
None
SMILES [?]:
Cc1cc(n(n1)CC(=O)NCC23CC4CC(C2)CC(C4)C3)C(F)F
InChi [?]:
InChI=1/C18H25F2N3O/c1-11-2-15(17(19)20)23(22-11)9-16(24)21-10-18-6-12-3-13(7-18)5-14(4-12)8-18/h2,12-14,17H,3-10H2,1H3,(H,21,24)
InChi Info:
AuxInfo=1/1/N:1,3,15,18,20,17,13,21,7,11,2,16,14,19,4,8,22,12,23,24,10,6,5,9/E:(3,4,5)(6,7,8)(12,13,14)(19,20)/rA:24nCCCCNNCCONCCCCCCCCCCCCFF/rB:s1;s2;d3;s4;d2s5;s5;s7;d8;s8;s10;s11;s12;s13;s14;s15;s12s16;s16;s18;s14s19;s12s19;s4;s22;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C18H25F2N3O |
All Atoms: | 49 |
Heavy Atoms: | 24 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 7.68026 |
Area: | 507.774 |
Solvation: | -5.0141 |
Coulombic: | -34.3576 |
Bond Count [?]
All: | 27 |
Single: | 24 |
Double: | 3 |
Rotors: | 6 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 4.21 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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