200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 1253740-09-8
1253740-09-8 | 2-Propanone, 1-(12,13-dihydro-2-hydroxy-1-methoxy-12-methyl[1,3]benzodioxolo[5,6-c]phenanthridin-13-yl)-
CAS No: 1253740-09-8 Catalog No: AG000NK1 MDL No:MFCD20274578
Product Description
Catalog Number:
AG000NK1
Chemical Name:
2-Propanone, 1-(12,13-dihydro-2-hydroxy-1-methoxy-12-methyl[1,3]benzodioxolo[5,6-c]phenanthridin-13-yl)-
CAS Number:
1253740-09-8
Molecular Formula:
C23H21NO5
Molecular Weight:
391.4165
MDL Number:
MFCD20274578
IUPAC Name:
1-(2-hydroxy-1-methoxy-12-methyl-13H-[1,3]benzodioxolo[5,6-c]phenanthridin-13-yl)propan-2-one
InChI:
InChI=1S/C23H21NO5/c1-12(25)8-17-21-14(6-7-18(26)23(21)27-3)15-5-4-13-9-19-20(29-11-28-19)10-16(13)22(15)24(17)2/h4-7,9-10,17,26H,8,11H2,1-3H3
InChI Key:
UTNGZOZDCCIQFH-UHFFFAOYSA-N
SMILES:
COc1c(O)ccc2c1C(CC(=O)C)N(C)c1c2ccc2c1cc1OCOc1c2
Properties
Complexity:
628
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
391.142g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
391.423g/mol
Monoisotopic Mass:
391.142g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
68.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.