10H-Pyrido(3,2-b)(1,4)benzothiazine-10-carboxylic acid, 3-(dipropylamino)propyl ester, hydrochloride
Basic information
- CAS
63885-79-0- Standard SMILES
CCCN(CCC)CCCOC(=O)N1c2ccccc2Sc2cccnc21.Cl- InChIKey
RUQZOBDMEROYLZ-UHFFFAOYSA-N- Molecular formula
- C21H28ClN3O2S
- Average molar mass
- 422 g/mol
- Monoisotopic mass
- 421.159076
Names & identifiers
- Preferred name
- 10H-Pyrido(3,2-b)(1,4)benzothiazine-10-carboxylic acid, 3-(dipropylamino)propyl ester, hydrochloride
- IUPAC
- 3-(dipropylamino)propyl pyrido[3,2-b][1,4]benzothiazine-10-carboxylate;hydrochloride
Names & synonyms
D 28110H-Pyrido(3,2-b)(1,4)benzothiazine-10-carboxylic acid, 3-(dipropylamino)propyl ester, hydrochloride63885-79-0DTXSID40213450RefChem:236061DTXCID401359413-(Dipropylamino)propyl 10H-pyrido[3,2-b][1,4]benzothiazine-10-carboxylate--hydrogen chloride (1/1)
Database identifiers
- CAS
63885-79-0- PubChem CID
- 3048136
- DTXSID
DTXSID40213450
Properties
Computed structural properties
- Topological polar surface area
- 71 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 459
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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