Spiro(cyclopentane-1,5'(6'H)-cyclopenta(e)thiazolo(3,2-a)pyrimidine), 7',8'-dihydro-1'-methyl-, monohydrochloride
Basic information
- CAS
21457-14-7- Standard SMILES
CC1=CSC2=NC3(CCCC3)C3=C(CCC3)N12.Cl- InChIKey
QBRCZDJNNOBBEF-UHFFFAOYSA-N- Molecular formula
- C14H19ClN2S
- Average molar mass
- 282.8 g/mol
- Monoisotopic mass
- 282.0957475
Names & identifiers
- Preferred name
- Spiro(cyclopentane-1,5'(6'H)-cyclopenta(e)thiazolo(3,2-a)pyrimidine), 7',8'-dihydro-1'-methyl-, monohydrochloride
- IUPAC
- 12-methylspiro[10-thia-1,8-diazatricyclo[7.3.0.02,6]dodeca-2(6),8,11-triene-7,1'-cyclopentane];hydrochloride
Names & synonyms
Spiro(cyclopentane-1,5'(6'H)-cyclopenta(e)thiazolo(3,2-a)pyrimidine), 7',8'-dihydro-1'-methyl-, monohydrochloride21457-14-7RefChem:381054DTXSID609440521'-Methyl-7',8'-dihydro-6'H-spiro[cyclopentane-1,5'-cyclopenta[e][1,3]thiazolo[3,2-a]pyrimidine]--hydrogen chloride (1/1)
Database identifiers
- CAS
21457-14-7- PubChem CID
- 210639
- DTXSID
DTXSID60944052
Properties
Computed structural properties
- Topological polar surface area
- 40.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 467
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Compound notes
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