N-(2-chlorophenyl)-2-[[5-(2-hydroxyphenyl)-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide

Formula:C23H19N4O3ClS Mutagenic:none Tumorigenic:none Reproductive Effective:none N-(2-chlorophenyl)-2-[[5-(2-hydroxyphenyl)-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide is a drug-like molecule.

MolName	N-(2-chlorophenyl)-2-[[5-(2-hydroxyphenyl)-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
MolecularFormula	C23H19N4O3ClS
Smiles	COc(cccc1)c1-n1c(SCC(Nc(cccc2)c2Cl)=O)nnc1-c(cccc1)c1O
InChI	InChI=1S/C23H19ClN4O3S/c1-31-20-13-7-5-11-18(20)28-22(15-8-2-6-12-19(15)29)26-27-23(28)32-14-21(30)25-17-10-4-3-9-16(17)24/h2-13,29H,14H2,1H3,(H,25,30)
InChIK	RRGAGUCSHVHPNU-UHFFFAOYSA-N
TotalMolweight	466.948
Molweight	466.948
MonoisotopicMass	466.086638
CLogP	4.3276
CLogS	-8.281
H Acceptors	7
H Donors	2
TotalSurfaceArea	343.75
Relative PSA	0.27316
PolarSurfaceArea	114.57
Druglikeness	3.3058
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	low
Nasty Functions
Shape Index	0.46875
Fragments	1
Non HAtoms	32
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	7
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	23
Sp3Atoms	5
Amides	1
Aromatic Nitrogens	3
StereoCon

Click to Load Molecule:

1 - N-(2-chlorophenyl)-2-[[5-(2-hydroxyphenyl)-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide | 2 - N-(2-chlorophenyl)-2-[[5-(2-hydroxyphenyl)-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide

Request More Details | N-(2-chlorophenyl)-2-[[5-(2-hydroxyphenyl)-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments