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Home > Encyclopedia > (Z)-but-2-enedioic acid,2-[4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]ethyl 3,4,5-trimethoxybenzoate

(Z)-but-2-enedioic acid,2-[4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]ethyl 3,4,5-trimethoxybenzoate

(Z)-but-2-enedioic acid,2-[4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]ethyl 3,4,5-trimethoxybenzoate structure

(Z)-but-2-enedioic acid,2-[4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]ethyl 3,4,5-trimethoxybenzoate 

structure
  • CAS No:

    34775-68-3

  • Formula:

    C38H41ClN2O13S

  • Chemical Name:

    (Z)-but-2-enedioic acid,2-[4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]ethyl 3,4,5-trimethoxybenzoate

(Z)-but-2-enedioic acid,2-[4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]ethyl 3,4,5-trimethoxybenzoate Basic Attributes

801.25600

800.2017882

Characteristics

234.97000

4.88820

633.1ºC

336.7ºC

Computed Properties

Molecular Weight:801.3
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:16
Rotatable Bond Count:13
Exact Mass:800.2017882
Monoisotopic Mass:800.2017882
Topological Polar Surface Area:235
Heavy Atom Count:55
Complexity:891
Undefined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes

Guide of (Z)-but-2-enedioic acid,2-[4-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]ethyl 3,4,5-trimethoxybenzoate

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