6-[(1S)-1,3-Dihydroxy-1-[1-(triphenylmethyl)-1H-imidazol-4-yl]propyl]-N-methyl-2-naphthalenecarboxamide

HCID 57465808

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Grundinformationen

CAS: 566200-79-1
Standard-SMILES: CNC(=O)c1ccc2cc([C@@](O)(CCO)c3cn(C(c4ccccc4)(c4ccccc4)c4ccccc4)cn3)ccc2c1
InChIKey: UXPBYIZHMMSNDJ-BHVANESWSA-N
Summenformel: C37H33N3O3
Durchschnittliche Molmasse: 567,7 g/mol
Monoisotopische Masse: 567,25219192

Namen und Bezeichner

Bevorzugter Name: 6-[(1S)-1,3-Dihydroxy-1-[1-(triphenylmethyl)-1H-imidazol-4-yl]propyl]-N-methyl-2-naphthalenecarboxamide
IUPAC: 6-[(1S)-1,3-dihydroxy-1-(1-tritylimidazol-4-yl)propyl]-N-methylnaphthalene-2-carboxamide
Englischer Name: (S)-6-(1,3-dihydroxy-1-(1-trityl-1H-iMidazol-4-yl)propyl)-N-Methyl-2-naphthaMide
Summenformel: C37H33N3O3
Molmasse: 567.68

Namen und Synonyme

566200-79-16-[(1S)-1,3-Dihydroxy-1-[1-(triphenylmethyl)-1H-imidazol-4-yl]propyl]-N-methyl-2-naphthalenecarboxamide6-((1S)-1,3-Dihydroxy-1-(1-(triphenylmethyl)-1H-imidazol-4-yl)propyl)-N-methyl-2-naphthalenecarboxamideRefChem:306393(S)-6-(1,3-dihydroxy-1-(1-trityl-1H-imidazol-4-yl)propyl)-N-methyl-2-naphthamide6-[(1S)-1,3-dihydroxy-1-(1-tritylimidazol-4-yl)propyl]-N-methylnaphthalene-2-carboxamideC37H33N3O3SCHEMBL312882UXPBYIZHMMSNDJ-BHVANESWSA-NDTXSID301111659CS-M1439MFCD22124685

Weitere Namen anzeigen

2-Naphthalenecarboxamide, 6-[(1S)-1,3-dihydroxy-1-[1-(triphenylmethyl)-1H-imidazol-4-yl]propyl]-N-methyl-

AKOS0376499326-[(1S)-1,3-dihydroxy-1-(1-trityl-1H-imidazol-4-yl)propyl]-N-methyl-2-naphthamideCS-13911DB-224811NS000774836-[(1S)-1,3-dihydroxy-1-(1-trityl-1H -imidazol-4-yl)propyl]-N-methyl-2-naphthamide6-[(1S)-1,3-dihydroxy-1-(1-trityl-1H-imidazol-4-yl)propyl]-N-methyl-2-nap-hthamide6-[(1S)-1,3-dihydroxy-1-(1-tritylimidazol-4-yl)propyl]-N-methyl-naphthalene-2-carboxamide

Datenbank-Bezeichner

CAS: 566200-79-1
PubChem CID: 57465808
DTXSID: DTXSID301111659
EC Number: 620-448-6
Nikkaji: J2.812.527E

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 5,7
Polarare Oberfläche (TPSA): 87,4 Å²
H-Brücken-Donoren: 3
H-Brücken-Akzeptoren: 4
Frei drehbare Bindungen: 9
Schwere Atome: 43
Formalladung: 0
Komplexität: 850

Physikochemische Eigenschaften

Aggregatzustand: Solid

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 3 Einträge

This chemical does not meet GHS hazard criteria for 100% (3 of 3) of all reports.

Not Classified；Reported as not meeting GHS hazard criteria by 3 of 3 companies. For more detailed information, please visit ECHA C&L website.

Aggregated GHS information provided per 3 reports by companies from 1 notifications to the ECHA C&L Inventory.；Reported as not meeting GHS hazard criteria per 3 of 3 reports by companies.；There are 0 notifications provided by 0 of 3 reports by companies with hazard statement code(s).；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.