[[4-[2-[[(3-Ethyl-2,5-dihydro-4-methyl-2-oxo-1H-pyrrol-1-yl)carbonyl]amino]ethyl]phenyl]sulfonyl]-carbamic acid ethyl ester supplier

Name
[[4-[2-[[(3-Ethyl-2,5-dihydro-4-methyl-2-oxo-1H-pyrrol-1-yl)carbonyl]amino]ethyl]phenyl]sulfonyl]-carbamic acid ethyl ester
EINECS
CAS No. 318515-70-7
Density 1.293g/cm³
Solubility
Melting Point
Formula C₁₉H₂₅N₃O₆S
Boiling Point
Molecular Weight 423.48
Flash Point
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Carbamicacid, [[4-[2-[[(3-ethyl-2,5-dihydro-4-methyl-2-oxo-1H-pyrrol-1-yl)carbonyl]amino]ethyl]phenyl]sulfonyl]-,ethyl ester (9CI);
PSA 130.26000
LogP 3.74270

[[4-[2-[[(3-Ethyl-2,5-dihydro-4-methyl-2-oxo-1H-pyrrol-1-yl)carbonyl]amino]ethyl]phenyl]sulfonyl]-carbamic acid ethyl ester Specification

The [[4-[2-[[(3-Ethyl-2,5-dihydro-4-methyl-2-oxo-1H-pyrrol-1-yl)carbonyl]amino]ethyl]phenyl]sulfonyl]-carbamic acid ethyl ester, with cas registry number 318515-70-7, belongs to the following product categories: (1)PHARMACEUTICAL INTERMEDIATES; (2)Heterocyclic Compounds; (3)Heterocycles; (4)Sulfur & Selenium Compounds. It has the systematic name of ethyl N-[4-[2-[(4-ethyl-3-methyl-5-oxo-2H-pyrrole-1-carbonyl)amino]ethyl]phenyl]sulfonylcarbamate.

Physical properties about this chemical are: (1)ACD/LogP: 1.50; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.14; (4)#H bond acceptors: 9; (5)#H bond donors: 2; (6)#Freely Rotating Bonds: 7; (7)Polar Surface Area: 130.26 Å²; (8)Index of Refraction: 1.563; (9)Molar Refractivity: 106.44 cm³; (10)Molar Volume: 327.4 cm³; (11)Polarizability: 42.19×10^-24cm³; (12)Surface Tension: 50.2 dyne/cm.

You can still convert the following datas into molecular structure:
(1)SMILES: CCC1=C(CN(C1=O)C(=O)NCCc2ccc(cc2)S(=O)(=O)NC(=O)OCC)C
(2)InChI: InChI=1/C19H25N3O6S/c1-4-16-13(3)12-22(17(16)23)18(24)20-11-10-14-6-8-15(9-7-14)29(26,27)21-19(25)28-5-2/h6-9H,4-5,10-12H2,1-3H3,(H,20,24)(H,21,25)
(3)InChIKey: QPESVQUXCCFSRB-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C19H25N3O6S/c1-4-16-13(3)12-22(17(16)23)18(24)20-11-10-14-6-8-15(9-7-14)29(26,27)21-19(25)28-5-2/h6-9H,4-5,10-12H2,1-3H3,(H,20,24)(H,21,25)
(5)Std. InChIKey: QPESVQUXCCFSRB-UHFFFAOYSA-N

Product Name

[[4-[2-[[(3-Ethyl-2,5-dihydro-4-methyl-2-oxo-1H-pyrrol-1-yl)carbonyl]amino]ethyl]phenyl]sulfonyl]-carbamic acid ethyl ester

[[4-[2-[[(3-Ethyl-2,5-dihydro-4-methyl-2-oxo-1H-pyrrol-1-yl)carbonyl]amino]ethyl]phenyl]sulfonyl]-carbamic acid ethyl ester Specification

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