DTXSID20992973

[5-[[4,6-bis(aziridin-1-yl)-1,3,5-triazin-2-yl]amino]-2-phenyl-1,3-dioxan-5-yl]methanol

CAS: 72239-51-1

Molecular Formula	`C18H22N6O3`
Molecular Weight	370.4 g/mol
LogP	1.1
Topological Polar Surface Area	95.4 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	9
Rotatable Bonds	6
Exact Mass	370.17532
Heavy Atoms	27
Complexity	483.0

Chemical Identifiers

CAS Number	72239-51-1
SMILES	`C1CN1C2=NC(=NC(=N2)NC3(COC(OC3)C4=CC=CC=C4)CO)N5CC5`
InChIKey	`VPZWBHONOYDQMO-UHFFFAOYSA-N`

📖 Product Overview

DTXSID20992973 (CAS: 72239-51-1) is a chemical compound with molecular formula C18H22N6O3 and molecular weight 370.4 g/mol. Its IUPAC systematic name is [5-[[4,6-bis(aziridin-1-yl)-1,3,5-triazin-2-yl]amino]-2-phenyl-1,3-dioxan-5-yl]methanol. LogP 1.1 Topological Polar Surface Area 95.4 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 9 Rotatable Bonds 6 Exact Mass 370.17532 Heavy Atoms 27 Complexity 483.0 InChI Key: VPZWBHONOYDQMO-UHFFFAOYSA-N. SMILES: C1CN1C2=NC(=NC(=N2)NC3(COC(OC3)C4=CC=CC=C4)CO)N5CC5.

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