[(Z)-2-benzamido-1-chloro-3-morpholin-4-yl-3-oxoprop-1-enyl]-triphenylphosphanium

Formula:C32H29N2O3ClP Mutagenic:none Tumorigenic:none Reproductive Effective:none [(Z)-2-benzamido-1-chloro-3-morpholin-4-yl-3-oxoprop-1-enyl]-triphenylphosphanium is not a drug-like molecule.

MolName	[(Z)-2-benzamido-1-chloro-3-morpholin-4-yl-3-oxoprop-1-enyl]-triphenylphosphanium
MolecularFormula	C32H29N2O3ClP
Smiles	O=C(/C(/NC(c1ccccc1)=O)=C(\[P+](c1ccccc1)(c1ccccc1)c1ccccc1)/Cl)N1CCOCC1
InChI	InChI=1S/C32H28ClN2O3P/c33-30(29(32(37)35-21-23-38-24-22-35)34-31(36)25-13-5-1-6-14-25)39(26-15-7-2-8-16-26,27-17-9-3-10-18-27)28-19-11-4-12-20-28/h1-20H,21-24H2/p+1
InChIK	FNWDRXGIBZOWLB-UHFFFAOYSA-O
TotalMolweight	556.02
Molweight	556.02
MonoisotopicMass	555.160432
CLogP	7.2721
CLogS	-7.11
H Acceptors	5
H Donors	1
TotalSurfaceArea	413.18
Relative PSA	0.12365
PolarSurfaceArea	58.64
Druglikeness	-3.5982
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	polar activated DB; phosphonium; 3-halo-enone
Shape Index	0.33333
Fragments	1
Non HAtoms	39
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	7
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	24
Sp3Atoms	6
Symmetricatoms	18
Amides	2
StereoCon

Click to Load Molecule:

1 - [(Z)-2-benzamido-1-chloro-3-morpholin-4-yl-3-oxoprop-1-enyl]-triphenylphosphanium | 2 - [(Z)-2-benzamido-1-chloro-3-morpholin-4-yl-3-oxoprop-1-enyl]-triphenylphosphanium

Request More Details | [(Z)-2-benzamido-1-chloro-3-morpholin-4-yl-3-oxoprop-1-enyl]-triphenylphosphanium

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments