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Prosultiamine

Prosultiamine structure

CAS No:
59-58-5
Formula:
C15H24N4O2S2
Chemical Name:
Prosultiamine
Synonyms:
Formamide,N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-N-[4-hydroxy-1-methyl-2-(propyldithio)-1-buten-1-yl]-;Formamide,N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-N-[4-hydroxy-1-methyl-2-(propyldithio)-1-butenyl]-;N-[(4-Amino-2-methyl-5-pyrimidinyl)methyl]-N-[4-hydroxy-1-methyl-2-(propyldithio)-1-buten-1-yl]formamide;Alinamin;N-[4-Amino-2-methyl-5-pyrimidinyl)methyl]-N-[4-hydroxy-1-methyl-2-(propyldithio)-1-butenyl]formamide;Dithiopropylthiamine;2-[2′-Methyl-4′-aminopyrimidyl-(5′)]-methylformamido-5-hydroxy-Δ2-pentenyl-(3)-propyl disulfide;Prosultiamine;Thiamine propyl disulfide;TPD;Vitamin B1 propyl disulfide;Prosulthiamine;Arinamine;Tipidi;Nervilon;Neurvita;Aliton;Nevriton;Nuvelbi V. C. A.;Tiotiamina;Tiovit-B1;Thiamin propyl disulfide;Taketron;Binova;NSC 23893;NSC 677470;114401-59-1
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Prosultiamine Basic Attributes

Molecular Weight：

356.507

Exact Mass：

356.51

EC Number：

200-436-3

DSSTox ID：

DTXSID1046633

Characteristics

PSA：

142.94000

XLogP3：

3.41

Density：

1.3±0.1 g/cm3

Melting Point：

128.5 °C (decomp)

Boiling Point：

593.7±50.0 °C at 760 mmHg

Flash Point：

312.9±30.1 °C

Refractive Index：

1.620

Safety Information

hazard class code：

R20/21/22

safety instructions：

26-36/37/39

Drug Information

MeSH Entry Terms：

Alinamin

Computed Properties

Molecular Weight:356.5
XLogP3:1.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:356.13406837
Monoisotopic Mass:356.13406837
Topological Polar Surface Area:143
Heavy Atom Count:23
Complexity:396
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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