Jtv-519
3-(4-benzylpiperidin-1-yl)-1-(7-methoxy-3,5-dihydro-2H-1,4-benzothiazepin-4-yl)propan-1-one;hydrochloride
Molecular Identity
Jtv-519
3-(4-benzylpiperidin-1-yl)-1-(7-methoxy-3,5-dihydro-2H-1,4-benzothiazepin-4-yl)propan-1-one;hydrochloride
PubChem CID: 9868902
2D Structure
Properties
C25H33ClN2O2S
Molecular Formula
461.10
Molecular Weight
g/mol
460.1951
Exact Mass
Da
58.1
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
4
H-Bond Acceptors
531
Complexity
SMILES
Canonical SMILES
SMILES: COC1=CC2=C(C=C1)SCCN(C2)C(=O)CCN3CCC(CC3)CC4=CC=CC=C4.ClIsomeric SMILES
SMILES: COC1=CC2=C(C=C1)SCCN(C2)C(=O)CCN3CCC(CC3)CC4=CC=CC=C4.ClSynonyms(20)
1038410-88-6JTV 519K201JTV-519K-201JTV5190I621Y6R4QK 201RefChem:201352JTV-519 hydrochloride3-(4-benzylpiperidin-1-yl)-1-(7-methoxy-2,3-dihydrobenzo[f][1,4]thiazepin-4(5H)-yl)propan-1-one hydrochlorideK201 compoundUNII-0I621Y6R4QK201 hydrochlorideJTV519 hydrpchloride
Data from PubChem (NCBI)
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Drug Network
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