(1R,2S,9S,12S,13R,16S)-9,13-dimethyl-6,7-diazapentacyclo[10.8.0.02,9.04,8.013,18]icosa-4(8),5,18-trien-16-ol
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(1R,2S,9S,12S,13R,16S)-9,13-dimethyl-6,7-diazapentacyclo[10.8.0.02,9.04,8.013,18]icosa-4(8),5,18-trien-16-ol
structure -
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CAS No:
5108-93-0
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Formula:
C20H28N2O
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Chemical Name:
(1R,2S,9S,12S,13R,16S)-9,13-dimethyl-6,7-diazapentacyclo[10.8.0.02,9.04,8.013,18]icosa-4(8),5,18-trien-16-ol
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Synonyms:
NSC48617;5108-93-0;MLS002667208;(2s,4ar,4bs,6as,10as,10br)-4a,6a-dimethyl-1,2,3,4,4a,4b,5,6,6a,7,10,10a,10b,11-tetradecahydronaphtho[2',1':4,5]indeno[1,2-c]pyrazol-2-ol;CHEMBL4296824;DTXSID80287014;ZINC4706213;NSC-48617;3beta-Hydroxy-androst-5-eno[17,16-c]pyrazole
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CAS No:
(1R,2S,9S,12S,13R,16S)-9,13-dimethyl-6,7-diazapentacyclo[10.8.0.02,9.04,8.013,18]icosa-4(8),5,18-trien-16-ol Basic Attributes
312.4 g/mol
312.220163521 g/mol
48617
DTXSID80287014
Computed Properties
Molecular Weight:312.4
XLogP3:3.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Exact Mass:312.220163521
Monoisotopic Mass:312.220163521
Topological Polar Surface Area:48.9
Heavy Atom Count:23
Complexity:546
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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