Ethyl 2-amino-6,8-dimethyl-4,5-dihydropyrrolo[3,2-e][1,3]benzothiazole-7-carboxylate
Basic information
- CAS
84990-27-2- Standard SMILES
CCOC(=O)c1c(C)c2c(n1C)CCc1sc(N)nc1-2- InChIKey
RCIDTDAKOCBPNQ-UHFFFAOYSA-N- Molecular formula
- C14H17N3O2S
- Average molar mass
- 291.37 g/mol
- Monoisotopic mass
- 291.10414797
Names & identifiers
- Preferred name
- Ethyl 2-amino-6,8-dimethyl-4,5-dihydropyrrolo[3,2-e][1,3]benzothiazole-7-carboxylate
- IUPAC
- ethyl 2-amino-6,8-dimethyl-4,5-dihydropyrrolo[3,2-e][1,3]benzothiazole-7-carboxylate
Names & synonyms
84990-27-2NSC297350ethyl 2-amino-6,8-dimethyl-4,5-dihydropyrrolo[3,2-e][1,3]benzothiazole-7-carboxylateDTXSID70315794NSC-297350Ethyl 2-amino-6,8-dimethyl-5,6-dihydro-4H-[1,3]thiazolo[4,5-e]indole-7-carboxylate
Database identifiers
- CAS
84990-27-2- PubChem CID
- 326310
- DTXSID
DTXSID70315794
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 98.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 395
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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