Basic information
- CAS
76870-23-0- Standard SMILES
O=C(c1ccc(NC(=S)Nc2cccc3ccccc23)cc1)N1CCCCC1- InChIKey
ZFMYOZYMEUHFGX-UHFFFAOYSA-N- Molecular formula
- C23H23N3OS
- Average molar mass
- 389.5 g/mol
- Monoisotopic mass
- 389.15618354
Names & identifiers
- Preferred name
- Piperidine, 1-(4-(((1-naphthalenylamino)thioxomethyl)amino)benzoyl)-
- IUPAC
- 1-naphthalen-1-yl-3-[4-(piperidine-1-carbonyl)phenyl]thiourea
- English name
- Piperidine, 1-(4-(((1-naphthalenylamino)thioxomethyl)amino)benzoyl)-
- Molecular formula
- C23H23N3OS
- Molecular weight
- 389.51
Names & synonyms
76870-23-0Piperidine, 1-(4-(((1-naphthalenylamino)thioxomethyl)amino)benzoyl)-1-(4-(((1-Naphthalenylamino)thioxomethyl)amino)benzoyl)piperidineDTXSID60227675RefChem:373081DTXCID10150166AKOS003686196N-(Naphthalen-1-yl)-N'-[4-(piperidine-1-carbonyl)phenyl]thioureaThiourea, N-1-naphthalenyl-N'-[4-(1-piperidinylcarbonyl)phenyl]-
Database identifiers
- CAS
76870-23-0- PubChem CID
- 3059617
- DTXSID
DTXSID60227675
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 76.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 540
Physicochemical properties
- EWG's Food Scores
- 1 · 1
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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