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1,2,4-thiadiazinane 1,1-dioxide

1,2,4-thiadiazinane 1,1-dioxide structure

CAS No:
38668-01-8
Formula:
C3H8N2O2S
Chemical Name:
1,2,4-thiadiazinane 1,1-dioxide
Synonyms:
Taurultam; Taurultamum; Taurultamum [INN-Latin]; UNII-LIX7OM008P;
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

Description

Taurultam is a reversible metabolite of taurolidine and an amino acid taurine derivative, with antibacterial and antineoplastic activity. Taurultam, like its congener taurolidine, inhibits proliferation of microvascular endothelial cells, although to a lesser extent, by selectively inhibiting the adhesion of endothelial cells to laminin but not to collagen I and fibronectin.

1,2,4-thiadiazinane 1,1-dioxide Basic Attributes

Molecular Weight：

136.17300

Exact Mass：

136.03064868 g/mol

UNII：

LIX7OM008P

DSSTox ID：

DTXSID60191968

NCI Thesaurus Code：

C75290

Characteristics

PSA：

66.58000

XLogP3：

0.20490

Appearance：

White crystalline powder

Density：

1.295 g/cm3

Melting Point：

142-145ºC

Boiling Point：

273.8ºC at 760 mmHg

Flash Point：

119.4ºC

Refractive Index：

1.482

Safety Information

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

taurultam

Computed Properties

Molecular Weight:136.18
XLogP3:-1.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Exact Mass:136.03064868
Monoisotopic Mass:136.03064868
Topological Polar Surface Area:66.6
Heavy Atom Count:8
Complexity:157
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,2,4-thiadiazinane 1,1-dioxide

Description
Basic Attributes
Characteristics
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