In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 27th, 2005 | 17 | No |
Popular Name: Chlormezanone Chlormezanone
2-(4-chlorophenyl)-3-methyl-1$l^{6},3-thiazinane-1,1,4-trione
2-(4-chlorophenyl)-3-methyl-1,1-dioxo-1,3-thiazinan-4-one
2-(4-Chlorophenyl)-3-methyl-1,3-thiazinan-4-one 1,1-dioxide
2-(4-Chlorophenyl)-3-methyl-4-metathiazanone-1,1-dioxide
2-(4-Chlorophenyl)tetrahydro-3-methyl-4H,1,3-thiazin-4-one 1,1-Dioxide
2-(4-chlorophenyl)tetrahydro-3-methyl-4h,1,3-thiazin-4-one1,1-dioxide
2-(4-Chlorophenyl)tetrahydro-3-methyl-4H-1,3-thiazin-4-one 1,1-dioxide
2-(4-Chlorphenyl)-3-methyl-4-metathiazanon-1,1-dioxid
2-(p-Chlorophenyl)tetrahydro-3-methyl-4H-1,3-thiazin-4-one 1,1-dioxide
2-(p-Chlorphenyl)-3-methyl-1,3-perhydrothiazin-4-on-1,1-dioxide
2-(para-Chlorophenyl)tetrahydro-3-methyl-4H-1,3-thiazin-4-one, 1,1-dioxide
4H-1,3-Thiazin-4-one, 2-(4-chlorophenyl)tetrahydro-3-methyl-, 1,1-dioxide
4H-1,3-Thiazin-4-one, 2-(4-chlorophenyl)tetrahydro-3-methyl-1,1-dioxide
4H-1,3-Thiazin-4-one, 2-(p-chlorophenyl)tetrahydro-3-methyl-, 1,1,-dioxide
4H-1,3-Thiazin-4-one, 2-(p-chlorophenyl)tetrahydro-3-methyl-, 1,1-dioxide
4H-1,3-Thiazin-4-one, 2-(p-chlorophenyl)tetrahydro-3-methyl-1,1-dioxide
4H-1,3-Thiazin-4-one, tetrahydro-2-(p-chlorophenyl)-3-methyl-, 1,1-dioxide
80-77-3; Chlormezanone (JAN/INN); D00268; Trancopal (TN)
80-77-3; Chlormezanone; Prestwick_736
chlormezanona; chlormezanone; chlormezanonum
InChI=1/C11H12ClNO3S/c1-13-10(14)6-7-17(15,16)11(13)8-2-4-9(12)5-3-8/h2-5,11H,6-7H2,1H3
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
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Note Type | Comments | Provided By |
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ALOGPS_SOLUBILITY | 1.61e+00 g/l | DrugBank-approved |
MP | 114 | TCI |
MP | 114 - 116 | Enamine Building Blocks |
MP | 114...116 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Purity | 95% | Fluorochem |
therap | anxiolytic, muscle relaxant | MicroSource World Drugs |
Therapy | Anxiolytic; muscle relaxant | SMDC Pharmakon |
PUBCHEM_PATENT_ID | EP0098975A1; EP0170193A2; EP0170193B1; EP0199102A2; EP0209403A2; EP0209403B1; EP0211134A1; EP0214328A1; EP0214368A1; EP0228537A2; EP0228686A2; EP0232507A1; EP0232507B1; EP0237632A1; EP0244274A1; EP0244274B1; EP0258521A1; EP0262638A2; EP0267355B1; EP027180 | IBM Patent Data |
Target | Others | Selleck Chemicals |
No pre-computed analogs available. Try a structural similarity search.