 Home > Encyclopedia > Benzenesulfonyl fluoride, 4-chloro-3-[[[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)-4-pyrimidinyl]ethyl]phenyl]methyl]amino]carbonyl]-, sulfate (2:1)

Benzenesulfonyl fluoride, 4-chloro-3-[[[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)-4-pyrimidinyl]ethyl]phenyl]methyl]amino]carbonyl]-, sulfate (2:1)

Benzenesulfonyl fluoride, 4-chloro-3-[[[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)-4-pyrimidinyl]ethyl]phenyl]methyl]amino]carbonyl]-, sulfate (2:1) structure

CAS No:
20096-58-6
Formula:
C26H21Cl3FN5O3S.¹/2H2O4S
Chemical Name:
Benzenesulfonyl fluoride, 4-chloro-3-[[[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)-4-pyrimidinyl]ethyl]phenyl]methyl]amino]carbonyl]-, sulfate (2:1)
Synonyms:
Benzenesulfonyl fluoride,4-chloro-3-[[[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)-4-pyrimidinyl]ethyl]phenyl]methyl]amino]carbonyl]-,sulfate (2:1);Benzenesulfonyl fluoride,4-chloro-3-[[p-[2-[2,6-diamino-5-(3,4-dichlorophenyl)-4-pyrimidinyl]ethyl]benzyl]carbamoyl]-,sulfate (2:1);NSC 123987

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Benzenesulfonyl fluoride, 4-chloro-3-[[[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)-4-pyrimidinyl]ethyl]phenyl]methyl]amino]carbonyl]-, sulfate (2:1) Basic Attributes

Molecular Weight：

707.0 g/mol

Exact Mass：

705.008852 g/mol

NSC Number：

123987

DSSTox ID：

DTXSID80329468

Characteristics

PSA：

232 Å²

Computed Properties

Molecular Weight:707.0
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:8
Exact Mass:705.008852
Monoisotopic Mass:705.008852
Topological Polar Surface Area:232
Heavy Atom Count:44
Complexity:1000
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of Benzenesulfonyl fluoride, 4-chloro-3-[[[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)-4-pyrimidinyl]ethyl]phenyl]methyl]amino]carbonyl]-, sulfate (2:1)

Basic Attributes
Characteristics
Computed Properties
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