6-{[2-(6-chloro-2,3-dihydro-4H-1,4-benzoxazine-4-sulfonyl)-4-fluorophenyl]methyl}-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione

Chemical Structure Depiction of
6-{[2-(6-chloro-2,3-dihydro-4H-1,4-benzoxazine-4-sulfonyl)-4-fluorophenyl]methyl}-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione
Available: 121 mg
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mg
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Compound characteristics

Compound ID: K906-4927
Compound Name: 6-{[2-(6-chloro-2,3-dihydro-4H-1,4-benzoxazine-4-sulfonyl)-4-fluorophenyl]methyl}-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione
Molecular Weight: 487.89
Molecular Formula: C22 H15 Cl F N3 O5 S
Smiles: C1COc2ccc(cc2N1S(c1cc(ccc1CN1C(c2cccnc2C1=O)=O)F)(=O)=O)[Cl]
Stereo: ACHIRAL
logP: 2.4398
logD: 2.4398
logSw: -3.3153
Hydrogen bond acceptors count: 10
Polar surface area: 78.504
InChI Key: CYCOXTYCAZYWMO-UHFFFAOYSA-N
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