Chromeno(3,4-b)(1,4)benzothiazin-6(12H)-one

HCID 338569

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Basic information

CAS: 75908-14-4
Standard SMILES: O=c1oc2ccccc2c2c1Sc1ccccc1N2
InChIKey: BUPPVTUKPWAYCH-UHFFFAOYSA-N
Molecular formula: C15H9NO2S
Average molar mass: 267.3 g/mol
Monoisotopic mass: 267.0353997

Names & identifiers

Preferred name: Chromeno(3,4-b)(1,4)benzothiazin-6(12H)-one
IUPAC: 12H-chromeno[3,4-b][1,4]benzothiazin-6-one

Names & synonyms

Chromeno(3,4-b)(1,4)benzothiazin-6(12H)-one75908-14-44HO2NF1XS3UNII-4HO2NF1XS3NSC 361671NSC-361671DTXSID00226829(1)BENZOPYRANO(3,4-B)(1,4)BENZOTHIAZIN-6(12H)-ONEChromeno[3,4-b][1,4]benzothiazin-6(12H)-one[1]Benzopyrano[3,4-b][1,4]benzothiazin-6(12H)-oneRefChem:125847DTXCID80149320

Show more names

12H-chromeno[3,4-b][1,4]benzothiazin-6-oneNSC361671Oprea1_529309CHEMBL1977795BUPPVTUKPWAYCH-UHFFFAOYSA-NHMS1666G15CCG-54872NCI60_003301

Database identifiers

CAS: 75908-14-4
PubChem CID: 338569
DTXSID: DTXSID00226829
ChEMBL: CHEMBL1977795
UNII: 4HO2NF1XS3

Properties

Computed structural properties

XLogP: 3.5
Topological polar surface area: 63.6 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 0
Heavy atoms: 19
Formal charge: 0
Complexity: 434

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