 Home > Encyclopedia > (17-ethynyl-2,18-dimethyl-7-oxa-6-azapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,9-trien-17-yl) 2,6-diaminohexanoate

(17-ethynyl-2,18-dimethyl-7-oxa-6-azapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,9-trien-17-yl) 2,6-diaminohexanoate

(17-ethynyl-2,18-dimethyl-7-oxa-6-azapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,9-trien-17-yl) 2,6-diaminohexanoate structure

CAS No:
162070-22-6
Formula:
C28H39N3O3
Chemical Name:
(17-ethynyl-2,18-dimethyl-7-oxa-6-azapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,9-trien-17-yl) 2,6-diaminohexanoate
Synonyms:
Danazol lysinate;162070-22-6;DTXSID40936632;1-Ethynyl-10a,12a-dimethyl-2,3,3a,3b,4,5,10,10a,10b,11,12,12a-dodecahydro-1H-cyclopenta[7,8]phenanthro[3,2-d][1,2]oxazol-1-yl lysinate

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(17-ethynyl-2,18-dimethyl-7-oxa-6-azapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,9-trien-17-yl) 2,6-diaminohexanoate Basic Attributes

Molecular Weight：

465.6 g/mol

Exact Mass：

465.29914211 g/mol

Characteristics

PSA：

104 Å²

Computed Properties

Molecular Weight:465.6
XLogP3:3.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:465.29914211
Monoisotopic Mass:465.29914211
Topological Polar Surface Area:104
Heavy Atom Count:34
Complexity:895
Undefined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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2-aminoethyl 2,6-diaminohexanoate

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Guide of (17-ethynyl-2,18-dimethyl-7-oxa-6-azapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,9-trien-17-yl) 2,6-diaminohexanoate

Basic Attributes
Characteristics
Computed Properties
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