200,000+ products from a single source!
sales@angenechem.com
85331-45-9 | 2H-1,4-Thiazin-3(4H)-one, 4-(1-methylethyl)-2-[(1-methylethyl)amino]-
CAS No: 85331-45-9 Catalog No: AG004P81 MDL No:
Product Description
Catalog Number:
AG004P81
Chemical Name:
2H-1,4-Thiazin-3(4H)-one, 4-(1-methylethyl)-2-[(1-methylethyl)amino]-
CAS Number:
85331-45-9
Molecular Formula:
C10H18N2OS
Molecular Weight:
214.3277
IUPAC Name:
4-propan-2-yl-2-(propan-2-ylamino)-1,4-thiazin-3-one
InChI:
InChI=1S/C10H18N2OS/c1-7(2)11-9-10(13)12(8(3)4)5-6-14-9/h5-9,11H,1-4H3
InChI Key:
PUESITSBLBCCHX-UHFFFAOYSA-N
SMILES:
CC(NC1SC=CN(C1=O)C(C)C)C
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.114g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
214.327g/mol
Monoisotopic Mass:
214.114g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.