Basic information
- CAS
1188265-79-3- Standard SMILES
c1ccc2sc(NC3CCNCC3)nc2c1- InChIKey
WUUOUFAOQYLHQK-UHFFFAOYSA-N- Molecular formula
- C12H15N3S
- Average molar mass
- 233.33 g/mol
- Monoisotopic mass
- 233.09866848
Names & identifiers
- Preferred name
- N-(Piperidin-4-yl)-1,3-benzothiazol-2-amine
- IUPAC
- N-piperidin-4-yl-1,3-benzothiazol-2-amine
- English name
- Benzothiazol-2-yl-piperidin-4-yl-aMine hydrochloride, 98+% C12H15N3S, MW: 269.80
- Molecular formula
- C12H15N3S
- Molecular weight
- 233.3326
Names & synonyms
N-piperidin-4-yl-1,3-benzothiazol-2-amineN-(Piperidin-4-yl)-1,3-benzothiazol-2-amineSCHEMBL3575186DTXSID90561852WUUOUFAOQYLHQK-UHFFFAOYSA-NAKOS009376321Benzothiazol-2-yl-piperidin-4-yl-amineN-4-Piperidinyl-2-benzothiazolamine hydrochlorideBenzothiazol-2-yl-piperidin-4-yl-aMine hydrochloride, 98+% C12H15N3S, MW: 269.80
Database identifiers
- CAS
1188265-79-3- PubChem CID
- 14575274
- DTXSID
DTXSID90561852
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 65.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 230
Chemistry & industry
Suppliers4 total
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
江阴安博生物医药有限公司086-010-62176588 · [email protected]
上海相辉医药科技有限公司13611835272 13611835272 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]
Related reactions
6 records
Compound notes
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