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Chemical ID: 7254798
Chemical ID:
7254798
Name [?]:
2-[(4-methoxyphenyl)carbamoylmethyl-methyl-amino]-N-(m-tolyl)acetamide
SMILES [?]:
Cc1cccc(c1)NC(=O)CN(C)CC(=O)Nc2ccc(cc2)OC
InChi [?]:
InChI=1/C19H23N3O3/c1-14-5-4-6-16(11-14)21-19(24)13-22(2)12-18(23)20-15-7-9-17(25-3)10-8-15/h4-11H,12-13H2,1-3H3,(H,20,23)(H,21,24)
InChi Info:
AuxInfo=1/1/N:1,13,25,4,3,5,19,23,20,22,7,14,11,2,18,6,21,15,9,17,8,12,16,10,24/E:(7,8)(9,10)/rA:25cCCCCCCCNCOCNCCCONCCCCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s9;s11;s12;s12;s14;d15;s15;s17;s18;d19;s20;d21;d18s22;s21;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C19H23N3O3 |
All Atoms: | 48 |
Heavy Atoms: | 25 |
Chiral Atoms: | 1 |
ZAP Information [?]
Total: | 8.24671 |
Area: | 576.075 |
Solvation: | -6.15516 |
Coulombic: | -51.6954 |
Bond Count [?]
All: | 26 |
Single: | 18 |
Double: | 8 |
Rotors: | 9 |
Chiral: | 0 |
Rigid Segments: | 6 |
Chemical Properties
Molecular Weight: | 341.404 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 6 |
XLogP: | 1.89 |
LogP (Chemaxon): | 2.53 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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