N-tert-Butoxycarbonyl mirabegron

• CAS: 1329485-55-3
• Catalog Number: ACM1329485553
• Category: Other Products
• Molecular Weight: 496.62168
• Molecular Formula: C₂₆H₃₂N₄O₄S
• Synonyms: N-tert-Butoxycarbonyl Mirabegron;(2R)-2-(2-AMinothiazol-4-yl)-4-[2-[(2-hydroxy-2-phenylethyl)N-tert-butoxycarbonylaMino]ethyl]acetic Acid Anilide;2-AMino-N-[4-[2-[[(2R)-2-hydroxy-2-phenylethyl]N-tert-butoxycarbonylaMino]ethyl]phenyl]-4-thiazoleacetaMide

Custom Q&A

What is the molecular formula of N-tert-Butoxycarbonyl mirabegron?

The molecular formula of N-tert-Butoxycarbonyl mirabegron is C26H32N4O4S.

What are the synonyms for N-tert-Butoxycarbonyl mirabegron?

The synonyms for N-tert-Butoxycarbonyl mirabegron are N-tert-Butoxycarbonyl Mirabegron, 1329485-55-3, tert-butyl N-[2-[4-[[2-(2-amino-1,3-thiazol-4-yl)acetyl]amino]phenyl]ethyl]-N-[(2R)-2-hydroxy-2-phenylethyl]carbamate, and SCHEMBL17209111.

What is the molecular weight of N-tert-Butoxycarbonyl mirabegron?

The molecular weight of N-tert-Butoxycarbonyl mirabegron is 496.6 g/mol.

What is the IUPAC name of N-tert-Butoxycarbonyl mirabegron?

The IUPAC name of N-tert-Butoxycarbonyl mirabegron is tert-butyl N-[2-[4-[[2-(2-amino-1,3-thiazol-4-yl)acetyl]amino]phenyl]ethyl]-N-[(2R)-2-hydroxy-2-phenylethyl]carbamate.

What is the InChI code for N-tert-Butoxycarbonyl mirabegron?

The InChI code for N-tert-Butoxycarbonyl mirabegron is InChI=1S/C26H32N4O4S/c1-26(2,3)34-25(33)30(16-22(31)19-7-5-4-6-8-19)14-13-18-9-11-20(12-10-18)28-23(32)15-21-17-35-24(27)29-21/h4-12,17,22,31H,13-16H2,1-3H3,(H2,27,29)(H,28,32)/t22-/m0/s1.

What is the InChIKey of N-tert-Butoxycarbonyl mirabegron?

The InChIKey of N-tert-Butoxycarbonyl mirabegron is FVQURKCOFMEJLM-QFIPXVFZSA-N.

What are the canonical and isomeric SMILES of N-tert-Butoxycarbonyl mirabegron?

The canonical SMILES of N-tert-Butoxycarbonyl mirabegron is CC(C)(C)OC(=O)N(CCC1=CC=C(C=C1)NC(=O)CC2=CSC(=N2)N)CC(C3=CC=CC=C3)O.
The isomeric SMILES of N-tert-Butoxycarbonyl mirabegron is CC(C)(C)OC(=O)N(CCC1=CC=C(C=C1)NC(=O)CC2=CSC(=N2)N)C[C@@H](C3=CC=CC=C3)O.

What is the XLogP3-AA value of N-tert-Butoxycarbonyl mirabegron?

The XLogP3-AA value of N-tert-Butoxycarbonyl mirabegron is 3.4.

How many hydrogen bond donor and acceptor counts does N-tert-Butoxycarbonyl mirabegron have?

N-tert-Butoxycarbonyl mirabegron has 3 hydrogen bond donor counts and 7 hydrogen bond acceptor counts.

What is the topological polar surface area of N-tert-Butoxycarbonyl mirabegron?

The topological polar surface area of N-tert-Butoxycarbonyl mirabegron is 146 ?2.