Benzenesulfonamide,4-amino-N-2-thiazolyl-, sodium salt (1:1)

Reported in EPA TSCA Inventory.

The Sulfathiazole sodium, with the CAS registry number 144-74-1, is also known as Benzenesulfonamide, 4-amino-N-2-thiazolyl-, sodium salt (1:1). It belongs to the classification code of Drug / Therapeutic Agent. Its EINECS registry number is 205-638-5. This chemical's molecular formula is C₉H₈N₃NaO₂S₂ and molecular weight is 277.30. What's more, both its IUPAC name and systematic name are the same which is called Sodium (4-aminophenyl)sulfonyl-(1,3-thiazol-2-yl)azanide. It is a sulfonamide for the treatment of infection in susceptible strains.

Physical properties about Sulfathiazole sodium are: (1)ACD/LogP: 0.05; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.04; (4)ACD/LogD (pH 7.4): -0.26; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 24.92; (8)ACD/KOC (pH 7.4): 12.59; (9)#H bond acceptors: 5; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 98.92 Å²; (13)Flash Point: 243.8 °C; (14)Enthalpy of Vaporization: 74.38 kJ/mol; (15)Boiling Point: 479.5 °C at 760 mmHg; (16)Vapour Pressure: 2.35E-09 mmHg at 25 °C.

When you are dealing with this chemical, you should be very careful. This chemical is inflammation to the skin, eyes and respiratory system or other mucous membranes. Therefore, you should wear suitable protective clothing. You can not breathe the gas/fumes/vapour/spray and you should avoid contacting with skin and eyes. In case of contacting with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1) SMILES: [Na+].O=S(=O)([N-]c1nccs1)c2ccc(N)cc2
(2) InChI: InChI=1S/C9H8N3O2S2.Na/c10-7-1-3-8(4-2-7)16(13,14)12-9-11-5-6-15-9;/h1-6H,10H2;/q-1;+1
(3) InChIKey: GWIJGCIVKLITQK-UHFFFAOYSA-N

The toxicity data is as follows: