Basic information
- Standard SMILES
COc1ccc(CN(c2nccs2)S(=O)(=O)c2ccc3c(c2)OCCN3c2ccccc2C2CCOCC2)cc1- InChIKey
DSCRHWBVXNMHRS-UHFFFAOYSA-N- Molecular formula
- C30H31N3O5S2
- Average molar mass
- 577.7 g/mol
Names & identifiers
- Preferred name
- N-(4-methoxybenzyl)-4-(2-(tetrahydro-2H-pyran-4-yl)phenyl)-N-(thiazol-2-yl)-3,4-dihydro-2H-benzo[b][1,4]oxazine-7-sulfonamide
- IUPAC
- N-[(4-methoxyphenyl)methyl]-4-[2-(oxan-4-yl)phenyl]-N-(1,3-thiazol-2-yl)-2,3-dihydro-1,4-benzoxazine-7-sulfonamide
Names & synonyms
SCHEMBL15202343DSCRHWBVXNMHRS-UHFFFAOYSA-NN-(4-methoxybenzyl)-4-(2-(tetrahydro-2H-pyran-4-yl)phenyl)-N-(thiazol-2-yl)-3,4-dihydro-2H-benzo[b][1,4]oxazine-7-sulfonamide
Database identifiers
- PubChem CID
- 89761933
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 8
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 906
Related reactions
1 records
Compound notes
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