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Chemical ID: 7344222
Chemical ID:
7344222
Name [?]:
3-acetamido-N-(3-sulfamoylphenyl)-benzamide
SMILES [?]:
CC(=O)Nc1cccc(c1)C(=O)Nc2cccc(c2)S(=O)(=O)N
InChi [?]:
InChI=1/C15H15N3O4S/c1-10(19)17-12-5-2-4-11(8-12)15(20)18-13-6-3-7-14(9-13)23(16,21)22/h2-9H,1H3,(H,17,19)(H,18,20)(H2,16,21,22)
InChi Info:
AuxInfo=1/1/N:1,7,16,8,6,15,17,10,19,2,9,5,14,18,11,23,4,13,3,12,21,22,20/E:(21,22)/CRV:23.6/rA:23nCCONCCCCCCCONCCCCCCSOON/rB:s1;d2;s2;s4;s5;d6;s7;d8;d5s9;s9;d11;s11;s13;s14;d15;s16;d17;d14s18;s18;d20;d20;s20;/rC:;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C15H15N3O4S |
All Atoms: | 38 |
Heavy Atoms: | 23 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.66066 |
Area: | 527.175 |
Solvation: | -4.51871 |
Coulombic: | -55.7809 |
Bond Count [?]
All: | 24 |
Single: | 14 |
Double: | 10 |
Rotors: | 6 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 333.363 |
H-Bond Donors: | 4 |
H-Bond Acceptors: | 7 |
XLogP: | 0.71 |
LogP (Chemaxon): | 1.06 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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