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ethyl 6-methyl-2-(phenylcarbamothioylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate

ethyl 6-methyl-2-(phenylcarbamothioylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate structure

CAS No:
5684-00-4
Formula:
C18H21N3O2S2
Chemical Name:
ethyl 6-methyl-2-(phenylcarbamothioylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
Synonyms:
HMS2191G18;

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ethyl 6-methyl-2-(phenylcarbamothioylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Basic Attributes

Molecular Weight：

375.50800

Exact Mass：

375.10751927

NSC Number：

690140

DSSTox ID：

DTXSID90361298

Characteristics

PSA：

120.97000

XLogP3：

3.95300

Density：

1.343g/cm3

Boiling Point：

525.7ºC at 760 mmHg

Flash Point：

271.7ºC

Refractive Index：

1.696

Computed Properties

Molecular Weight:375.5
XLogP3:3.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:375.10751927
Monoisotopic Mass:375.10751927
Topological Polar Surface Area:114
Heavy Atom Count:25
Complexity:485
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 6-methyl-2-(phenylcarbamothioylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate

Basic Attributes
Characteristics
Computed Properties
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