6-chloro-N4-cyclopropyl-N4-(thiophen-2-ylmethyl)pyrimidine-2,4-diamine

6-chloro-N4-cyclopropyl-N4-(thiophen-2-ylmethyl)pyrimidine-2,4-diamine

Formula: C12H13ClN4S

SMILES: NC1=NC(=CC(Cl)=N1)N(CC1=CC=CS1)C1CC1

IUPAC: 6-chloro-N4-cyclopropyl-N4-[(thiophen-2-yl)methyl]pyrimidine-2,4-diamine

InChI: InChI=1S/C12H13ClN4S/c13-10-6-11(16-12(14)15-10)17(8-3-4-8)7-9-2-1-5-18-9/h1-2,5-6,8H,3-4,7H2,(H2,14,15,16)

Composition: C (51.33%), H (4.67%), Cl (12.63%), N (19.95%), S (11.42%)

Molar Mass: 280.77

Atom Count: 31

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	280.0549453
Formal Charge	0
FSP3	0.33
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	PDWZXKSZLRVSEH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	76.69
Topological Polar Surface Area	55.04
Polarizability	27.68
Ring Count	3
Rotatable Bond Count	4

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C12H13ClN4S		Quote Only