Sulfamonomethoxine

C₁₁H₁₂N₄O₃SCAS 1220-83-3280.30 g/mol

Open in Covalent MOL file

Ether Primary amine Sulfonamide

Properties

Molecular formula: C₁₁H₁₂N₄O₃S
Molar mass: 280.30 g/mol
Exact mass: 280.0630 Da
Melting point: 200–202 °C
logP: 0.87Crippen estimate
Polar surface area: 107.2 Å²
H-bond donors / acceptors: 2 / 6
Rotatable bonds: 4

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H317 May cause an allergic skin reaction100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation97.7% of notifiers

Aggregated from 43 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P272, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

1220-83-3

SMILES

COc1cc(NS(=O)(=O)c2ccc(N)cc2)ncn1

InChIKey

WMPXPUYPYQKQCX-UHFFFAOYSA-N

InChI

InChI=1S/C11H12N4O3S/c1-18-11-6-10(13-7-14-11)15-19(16,17)9-4-2-8(12)3-5-9/h2-7H,12H2,1H3,(H,13,14,15)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

15 names · show all

Benzenesulfonamide, 4-amino-N-(6-methoxy-4-pyrimidinyl)-
Sulfanilamide, N1-(6-methoxy-4-pyrimidinyl)-
4-Amino-N-(6-methoxy-4-pyrimidinyl)benzenesulfonamide
ICI 32525
N1-(6-Methoxy-4-pyrimidinyl)sulfanilamide
4-Methoxy-6-sulfanilamidopyrimidine
6-Methoxy-4-sulfanilamidopyrimidine
6-Sulfanilamido-4-methoxypyrimidine
4-Sulfanilamido-6-methoxypyrimidine
Daimeton
Sulfamonomethoxin
DJ 1550
DS 36
Ro 4-3476
Duphadin

Work with Sulfamonomethoxine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Sulfadimethoxine122-11-269 % similar Sulfadoxine2447-57-658 % similar Sulfapyridine144-83-250 % similar Sulfamethoxazole723-46-649 % similar Sulfisomidine515-64-048 % similar Sulfachlorpyridazine80-32-048 % similar Sulfamethazine57-68-146 % similar Sulfadiazine68-35-946 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Sulfalene152-47-6 Sulfamethoxydiazine651-06-9 Sulfamethoxypyridazine80-35-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook