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Chemical ID: 7486377
Chemical ID:
7486377
Name [?]:
N-[(2-hydroxy-1-naphthyl)methyleneamino]-2-(2-naphthyloxy)propanamide
SMILES [?]:
CC(C(=O)NN=Cc1c2ccccc2ccc1O)Oc3ccc4ccccc4c3
InChi [?]:
InChI=1/C24H20N2O3/c1-16(29-20-12-10-17-6-2-3-8-19(17)14-20)24(28)26-25-15-22-21-9-5-4-7-18(21)11-13-23(22)27/h2-16,27H,1H3,(H,26,28)
InChi Info:
AuxInfo=1/1/N:1,25,26,12,11,24,13,27,10,22,15,21,16,29,7,2,23,14,28,20,9,8,17,3,6,5,18,4,19/rA:29cCCCONNCCCCCCCCCCCOOCCCCCCCCCC/rB:s1;s2;d3;s3;s5;w6;s7;s8;s9;d10;s11;d12;d9s13;s14;d15;d8s16;s17;s2;s19;s20;d21;s22;s23;d24;s25;d26;d23s27;d20s28;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C24H20N2O3 |
All Atoms: | 49 |
Heavy Atoms: | 29 |
Chiral Atoms: | 1 |
ZAP Information [?]
Total: | 8.98439 |
Area: | 591.198 |
Solvation: | -5.79556 |
Coulombic: | -45.2177 |
Bond Count [?]
All: | 32 |
Single: | 20 |
Double: | 12 |
Rotors: | 6 |
Chiral: | 1 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 384.427 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 5 |
XLogP: | 6.33 |
LogP (Chemaxon): | 5.27 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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