General Information of the Compound
| Compound ID |
CP0523047
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| Compound Name |
1-(benzenesulfonyl)-2-methyl-4-piperazin-1-ylbenzimidazole
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| Structure |
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| Formula |
C18H20N4O2S
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| Molecular Weight |
356.451
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| Canonical SMILES |
Cc1nc2c(cccc2n1S(=O)(=O)c1ccccc1)N1CCNCC1
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| InChI |
InChI=1S/C18H20N4O2S/c1-14-20-18-16(21-12-10-19-11-13-21)8-5-9-17(18)22(14)25(23,24)15-6-3-2-4-7-15/h2-9,19H,10-13H2,1H3
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| InChIKey |
MAYQIFVKVAUMPD-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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