N-(2,4-dimethoxyphenyl)-4-[2,6-dimethyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl]piperazine-1-carboxamide

Formula:C27H33N5O3 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-(2,4-dimethoxyphenyl)-4-[2,6-dimethyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl]piperazine-1-carboxamide is a drug-like molecule.

MolName	N-(2,4-dimethoxyphenyl)-4-[2,6-dimethyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl]piperazine-1-carboxamide
MolecularFormula	C27H33N5O3
Smiles	Cc1ccc(Cc2c(C)nc(C)nc2N(CC2)CCN2C(Nc(ccc(OC)c2)c2OC)=O)cc1
InChI	InChI=1S/C27H33N5O3/c1-18-6-8-21(9-7-18)16-23-19(2)28-20(3)29-26(23)31-12-14-32(15-13-31)27(33)30-24-11-10-22(34-4)17-25(24)35-5/h6-11,17H,12-16H2,1-5H3,(H,30,33)
InChIK	GVRBFAWBJHIZOB-UHFFFAOYSA-N
TotalMolweight	475.591
Molweight	475.591
MonoisotopicMass	475.25834
CLogP	4.3717
CLogS	-4.797
H Acceptors	8
H Donors	1
TotalSurfaceArea	376.71
Relative PSA	0.19522
PolarSurfaceArea	79.82
Druglikeness	5.8778
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.57143
Fragments	1
Non HAtoms	35
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	12
Symmetricatoms	4
Amides	2
Aromatic Nitrogens	2
StereoCon

Click to Load Molecule:

1 - N-(2,4-dimethoxyphenyl)-4-[2,6-dimethyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl]piperazine-1-carboxamide | 2 - N-(2,4-dimethoxyphenyl)-4-[2,6-dimethyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl]piperazine-1-carboxamide

Request More Details | N-(2,4-dimethoxyphenyl)-4-[2,6-dimethyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl]piperazine-1-carboxamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments