UCSF

ZINC00096613

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 13 Yes

Popular Name: 1-Methyl-1H-benzo[d][1,3]oxazine-2,4-dione 1-Methyl-1H-benzo[d][1,3]oxazine…

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CAS Numbers: 10328-92-4 , [10328-92-4]

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.80 4.95 -12 0 4 0 52 177.159 0 ↓

Vendor Notes

Note Type Comments Provided By
MP 165 - 167 Enamine Building Blocks
MP 165...167 Enamine Building Blocks
MP 179 TCI
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Melting_Point ca 160? dec. Alfa-Aesar
Melting_Point ca 160° dec. Alfa-Aesar

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Analogs ( Draw Identity 99% 90% 80% 70% )