200,000+ products from a single source!
sales@angenechem.com
Home > Other Heterocycles > 102395-47-1
102395-47-1 | 1,3,8-Triazaspiro[4.5]decan-4-one, 8-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-3-ethyl-1-phenyl-
CAS No: 102395-47-1 Catalog No: AG0007CN MDL No:
Product Description
Catalog Number:
AG0007CN
Chemical Name:
1,3,8-Triazaspiro[4.5]decan-4-one, 8-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-3-ethyl-1-phenyl-
CAS Number:
102395-47-1
Molecular Formula:
C24H29N3O3
Molecular Weight:
407.5054
IUPAC Name:
8-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-ethyl-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
InChI:
InChI=1S/C24H29N3O3/c1-2-26-18-27(19-8-4-3-5-9-19)24(23(26)28)12-14-25(15-13-24)16-20-17-29-21-10-6-7-11-22(21)30-20/h3-11,20H,2,12-18H2,1H3
InChI Key:
RCKWQESNRPYDDB-UHFFFAOYSA-N
SMILES:
CCN1CN(C2(C1=O)CCN(CC2)CC1COc2c(O1)cccc2)c1ccccc1
NSC Number:
665788
Properties
Complexity:
601
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
407.221g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
407.514g/mol
Monoisotopic Mass:
407.221g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
45.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.