4H-1,3-Thiazin-2-amine, 5,6-dihydro-N-(4-(3-(4-phenyl-1-piperazinyl)propoxy)phenyl)-
Basic information
- CAS
85868-69-5- Standard SMILES
c1ccc(N2CCN(CCCOc3ccc(NC4=NCCCS4)cc3)CC2)cc1- InChIKey
HQVBRRAVAOPFJE-UHFFFAOYSA-N- Molecular formula
- C23H30N4OS
- Average molar mass
- 410.6 g/mol
- Monoisotopic mass
- 410.21403277
Names & identifiers
- Preferred name
- 4H-1,3-Thiazin-2-amine, 5,6-dihydro-N-(4-(3-(4-phenyl-1-piperazinyl)propoxy)phenyl)-
- IUPAC
- N-[4-[3-(4-phenylpiperazin-1-yl)propoxy]phenyl]-5,6-dihydro-4H-1,3-thiazin-2-amine
Names & synonyms
BRN 45870014H-1,3-Thiazin-2-amine, 5,6-dihydro-N-(4-(3-(4-phenyl-1-piperazinyl)propoxy)phenyl)-85868-69-55,6-Dihydro-N-(4-(3-(4-phenyl-1-piperazinyl)propoxy)phenyl)-4H-1,3-thiazin-2-amineDTXSID00235173RefChem:297073DTXCID00157664N-{4-[3-(4-Phenylpiperazin-1-yl)propoxy]phenyl}-5,6-dihydro-4H-1,3-thiazin-2-amine
Database identifiers
- CAS
85868-69-5- PubChem CID
- 3070140
- DTXSID
DTXSID00235173
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 65.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 495
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Compound notes
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