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Duplicate ID | |
---|---|
Smiles | Cc1cc(C)c2c(c1)sc(n2)N(C(=O)c1ccc2c(c1)OCCO2)CCn1cccn1 |
Cas Number | 1171955-59-1 |
InchiKey | UHAWIMKMJFJIBP-UHFFFAOYSA-N |
InChi | InChI=1S/C23H22N4O3S/c1-15-12-16(2)21-20(13-15)31-23(25-21)27(9-8-26-7-3-6-24-26)22(28)17-4-5-18-19(14-17)30-11-10-29-18/h3-7,12-14H,8-11H2,1-2H3 |
Formula | C23H22N4O3S |
Molecular weight | 434.511 |
Rings | 5 |
logP | 4.2278 |
PSA | 97.72 |
MR | 120.912 |