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89003-39-4 | 2,4(1H,3H)-Pyrimidinedione, dihydro-3-(4-morpholinylmethyl)-
CAS No: 89003-39-4 Catalog No: AG00469O MDL No:
Product Description
Catalog Number:
AG00469O
Chemical Name:
2,4(1H,3H)-Pyrimidinedione, dihydro-3-(4-morpholinylmethyl)-
CAS Number:
89003-39-4
Molecular Formula:
C9H15N3O3
Molecular Weight:
213.2337
IUPAC Name:
3-(morpholin-4-ylmethyl)-1,3-diazinane-2,4-dione
InChI:
InChI=1S/C9H15N3O3/c13-8-1-2-10-9(14)12(8)7-11-3-5-15-6-4-11/h1-7H2,(H,10,14)
InChI Key:
IWJLHNJRTTYFHI-UHFFFAOYSA-N
SMILES:
O=C1CCNC(=O)N1CN1CCOCC1
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.111g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
213.237g/mol
Monoisotopic Mass:
213.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
61.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.2
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