2-Amino-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3h)-one

HCID 290197

Completing data — usually done within a minute

Basic information

CAS
81766-02-1
Standard SMILES
Nc1nc2sc3c(c2c(=O)[nH]1)CCCC3
InChIKey
KMLONYHSKRNWBQ-UHFFFAOYSA-N
Molecular formula
C10H11N3OS
Average molar mass
221.28 g/mol
Monoisotopic mass
221.06228316

Names & identifiers

Preferred name
2-Amino-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3h)-one
IUPAC
2-amino-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one

Names & synonyms

81766-02-12-amino-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3h)-one2-Amino-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4(1H)-oneNSC153286SCHEMBL1368915DTXSID80302736KMLONYHSKRNWBQ-UHFFFAOYSA-NAKOS000280090NSC-1532862-amino-5,6,7,8-tetrahydro[1]-benzothieno[2,3-d]pyrimidin-4(3H)-one2-amino-5,6,7,8-tetrahydro[l]benzothieno[2,3-d]pyrimidin-4(3H)-one

Database identifiers

CAS
81766-02-1
PubChem CID
290197
DTXSID
DTXSID80302736

Properties

Computed structural propertiesFilling in

XLogP
1.4
Topological polar surface area
95.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
0
Heavy atoms
15

Related reactions

10 records

Compound notes

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