N-[(Z)-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)methylideneamino]-3-pyrrolidin-1-ylsulfonylbenzamide

Formula:C25H27N5O4S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)methylideneamino]-3-pyrrolidin-1-ylsulfonylbenzamide is not a drug-like molecule.

MolName	N-[(Z)-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)methylideneamino]-3-pyrrolidin-1-ylsulfonylbenzamide
MolecularFormula	C25H27N5O4S2
Smiles	O=C(c1cccc(S(N2CCCC2)(=O)=O)c1)N/N=C\c1c(-c2ccccc2)nc(N2CCOCC2)s1
InChI	InChI=1S/C25H27N5O4S2/c31-24(20-9-6-10-21(17-20)36(32,33)30-11-4-5-12-30)28-26-18-22-23(19-7-2-1-3-8-19)27-25(35-22)29-13-15-34-16-14-29/h1-3,6-10,17-18H,4-5,11-16H2,(H,28,31)
InChIK	FQEQFDVHSZPCQG-UHFFFAOYSA-N
TotalMolweight	525.652
Molweight	525.652
MonoisotopicMass	525.150445
CLogP	4.1931
CLogS	-5.27
H Acceptors	9
H Donors	1
TotalSurfaceArea	383.71
Relative PSA	0.29455
PolarSurfaceArea	140.82
Druglikeness	1.5528
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.5
Fragments	1
Non HAtoms	36
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	10
Symmetricatoms	7
Amides	1
Aromatic Nitrogens	1
StereoCon

Click to Load Molecule:

1 - N-[(Z)-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)methylideneamino]-3-pyrrolidin-1-ylsulfonylbenzamide | 2 - N-[(Z)-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)methylideneamino]-3-pyrrolidin-1-ylsulfonylbenzamide

Request More Details | N-[(Z)-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)methylideneamino]-3-pyrrolidin-1-ylsulfonylbenzamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments