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2,4-bis(butylsulfanyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indole

2,4-bis(butylsulfanyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indole structure

CAS No:
374085-71-9
Formula:
C18H27N3S2
Chemical Name:
2,4-bis(butylsulfanyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indole
Synonyms:
2,4-bis(butylsulfanyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indole;ZINC2117743;STK532331;AKOS005464878;MCULE-2912289224;AL-281/41529824;374085-71-9

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2,4-bis(butylsulfanyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indole Basic Attributes

Molecular Weight：

349.55708

Exact Mass：

349.165

Characteristics

PSA：

92.2

XLogP3：

6.1

Computed Properties

Molecular Weight:349.6
XLogP3:6.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:8
Exact Mass:349.16464022
Monoisotopic Mass:349.16464022
Topological Polar Surface Area:92.2
Heavy Atom Count:23
Complexity:355
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2,4-bis(butylsulfanyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indole

Basic Attributes
Characteristics
Computed Properties

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