(5Z)-1-(furan-2-ylmethyl)-5-[[1-(2-phenoxyethyl)pyrrol-2-yl]methylidene]-1,3-diazinane-2,4,6-trione

Formula:C22H19N3O5 Mutagenic:none Tumorigenic:none Reproductive Effective:high (5Z)-1-(furan-2-ylmethyl)-5-[[1-(2-phenoxyethyl)pyrrol-2-yl]methylidene]-1,3-diazinane-2,4,6-trione is a drug-like molecule.

MolName	(5Z)-1-(furan-2-ylmethyl)-5-[[1-(2-phenoxyethyl)pyrrol-2-yl]methylidene]-1,3-diazinane-2,4,6-trione
MolecularFormula	C22H19N3O5
Smiles	O=C(/C(/C(N1Cc2ccco2)=O)=C/c2cccn2CCOc2ccccc2)NC1=O
InChI	InChI=1S/C22H19N3O5/c26-20-19(21(27)25(22(28)23-20)15-18-9-5-12-29-18)14-16-6-4-10-24(16)11-13-30-17-7-2-1-3-8-17/h1-10,12,14H,11,13,15H2,(H,23,26,28)
InChIK	IGDDJXNGLVUJAS-UHFFFAOYSA-N
TotalMolweight	405.409
Molweight	405.409
MonoisotopicMass	405.132472
CLogP	1.451
CLogS	-2.713
H Acceptors	8
H Donors	1
TotalSurfaceArea	309.17
Relative PSA	0.27529
PolarSurfaceArea	93.78
Druglikeness	6.0366
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.56667
Fragments	1
Non HAtoms	30
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	7
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	4
Symmetricatoms	2
Amides	2
Aromatic Nitrogens	1
StereoCon

Click to Load Molecule:

1 - (5Z)-1-(furan-2-ylmethyl)-5-[[1-(2-phenoxyethyl)pyrrol-2-yl]methylidene]-1,3-diazinane-2,4,6-trione | 2 - (5Z)-1-(furan-2-ylmethyl)-5-[[1-(2-phenoxyethyl)pyrrol-2-yl]methylidene]-1,3-diazinane-2,4,6-trione

Request More Details | (5Z)-1-(furan-2-ylmethyl)-5-[[1-(2-phenoxyethyl)pyrrol-2-yl]methylidene]-1,3-diazinane-2,4,6-trione

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments