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8-[4-[4-(4-Chlorobenzyl)piperazide-1-sulfonyl)phenyl]]-1-propylxanthine

8-[4-[4-(4-Chlorobenzyl)piperazide-1-sulfonyl)phenyl]]-1-propylxanthine structure

CAS No:
1027513-54-7
Formula:
C25H27ClN6O4S
Chemical Name:
8-[4-[4-(4-Chlorobenzyl)piperazide-1-sulfonyl)phenyl]]-1-propylxanthine
Synonyms:
PSB-0788;PSB 0788;CHEMBL482436;PSB0788;8-(4-{4-[(4-chlorophenyl)methyl]piperazine-1-sulfonyl}phenyl)-1-propyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione;GTPL6561;SCHEMBL16099412;BDBM50268129;ZINC49867711;AKOS024457473

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8-[4-[4-(4-Chlorobenzyl)piperazide-1-sulfonyl)phenyl]]-1-propylxanthine Basic Attributes

Molecular Weight：

543.039

Exact Mass：

542.15

Characteristics

PSA：

127

XLogP3：

3.1

Density：

1.414±0.06 g/cm3(Predicted)

Melting Point：

>292 °C (decomp)

Storage Conditions：

Store at +4°C

Computed Properties

Molecular Weight:543.0
XLogP3:3.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:542.1503022
Monoisotopic Mass:542.1503022
Topological Polar Surface Area:127
Heavy Atom Count:37
Complexity:924
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 8-[4-[4-(4-Chlorobenzyl)piperazide-1-sulfonyl)phenyl]]-1-propylxanthine

Basic Attributes
Characteristics
Computed Properties

8-[4-[4-(4-Chlorobenzyl)piperazide-1-sulfonyl)phenyl]]-1-propylxanthine

SDS

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