2-(4-chlorophenyl)-5-[(1E,3E)-4-pyrrolidin-1-ylbuta-1,3-dienyl]tetrazole

Formula:C15H16N5Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-(4-chlorophenyl)-5-[(1E,3E)-4-pyrrolidin-1-ylbuta-1,3-dienyl]tetrazole is a drug-like molecule.

MolName	2-(4-chlorophenyl)-5-[(1E,3E)-4-pyrrolidin-1-ylbuta-1,3-dienyl]tetrazole
MolecularFormula	C15H16N5Cl
Smiles	Clc(cc1)ccc1-n1nnc(/C=C/C=C/N2CCCC2)n1
InChI	InChI=1S/C15H16ClN5/c16-13-6-8-14(9-7-13)21-18-15(17-19-21)5-1-2-10-20-11-3-4-12-20/h1-2,5-10H,3-4,11-12H2
InChIK	KCXVRJMUKBVIGK-UHFFFAOYSA-N
TotalMolweight	301.78
Molweight	301.78
MonoisotopicMass	301.109422
CLogP	2.8593
CLogS	-2.947
H Acceptors	5
TotalSurfaceArea	238.76
Relative PSA	0.18148
PolarSurfaceArea	46.84
Druglikeness	-0.47709
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.71429
Fragments	1
Non HAtoms	21
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	5
Symmetricatoms	4
Aromatic Nitrogens	4
BasicNitrogens	1
StereoCon

Click to Load Molecule:

1 - 2-(4-chlorophenyl)-5-[(1E,3E)-4-pyrrolidin-1-ylbuta-1,3-dienyl]tetrazole | 2 - 2-(4-chlorophenyl)-5-[(1E,3E)-4-pyrrolidin-1-ylbuta-1,3-dienyl]tetrazole

Request More Details | 2-(4-chlorophenyl)-5-[(1E,3E)-4-pyrrolidin-1-ylbuta-1,3-dienyl]tetrazole

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments