 Home > Encyclopedia > (9S,11S,12S)-9-(3-methylbutyl)-4,6-dioxa-16-azapentacyclo[9.7.1.03,7.08,19.012,16]nonadeca-1,3(7),8(19)-triene

(9S,11S,12S)-9-(3-methylbutyl)-4,6-dioxa-16-azapentacyclo[9.7.1.03,7.08,19.012,16]nonadeca-1,3(7),8(19)-triene

(9S,11S,12S)-9-(3-methylbutyl)-4,6-dioxa-16-azapentacyclo[9.7.1.03,7.08,19.012,16]nonadeca-1,3(7),8(19)-triene structure

CAS No:
163734-41-6
Formula:
C21H29NO2
Chemical Name:
(9S,11S,12S)-9-(3-methylbutyl)-4,6-dioxa-16-azapentacyclo[9.7.1.03,7.08,19.012,16]nonadeca-1,3(7),8(19)-triene
Synonyms:
HH07A;HH 07A;163734-41-6;HH07A;(1S,3S,4S)-HH 07A;DTXSID70167654;1H-Cyclopenta(jk)(1,3)dioxolo(4,5-h)pyrrolo(2,1-b)(3)benzazepine,2,7,8,10,11,12,12a,12b-octahydro-2-(3-methylbutyl)-, (2S-(2alpha,12aalpha,12balpha))-

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(9S,11S,12S)-9-(3-methylbutyl)-4,6-dioxa-16-azapentacyclo[9.7.1.03,7.08,19.012,16]nonadeca-1,3(7),8(19)-triene Basic Attributes

Molecular Weight：

327.5 g/mol

Exact Mass：

327.219829168 g/mol

DSSTox ID：

DTXSID70167654

Characteristics

PSA：

21.7 Å²

Drug Information

MeSH Entry Terms：

HH07A

Computed Properties

Molecular Weight:327.5
XLogP3:5
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:327.219829168
Monoisotopic Mass:327.219829168
Topological Polar Surface Area:21.7
Heavy Atom Count:24
Complexity:467
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (9S,11S,12S)-9-(3-methylbutyl)-4,6-dioxa-16-azapentacyclo[9.7.1.03,7.08,19.012,16]nonadeca-1,3(7),8(19)-triene

Basic Attributes
Characteristics
Drug Information
Computed Properties

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