DTXSID80927302

[(7R,8S)-11-(aziridin-1-yl)-7-methoxy-12-methyl-10,13-dioxo-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl]methyl carbamate

CAS: 13164-87-9

Molecular Formula	`C17H20N4O5`
Molecular Weight	360.4 g/mol
LogP	0.2
Topological Polar Surface Area	124.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	8
Rotatable Bonds	5
Exact Mass	360.14337
Heavy Atoms	26
Complexity	829.0

Chemical Identifiers

CAS Number	13164-87-9
SMILES	`CC1=C(C(=O)C2=C(C1=O)N3CC4C(C3(C2COC(=O)N)OC)N4)N5CC5`
InChIKey	`FKJOSOXAGBHNJN-QNTWZPOASA-N`

📖 Product Overview

DTXSID80927302 (CAS: 13164-87-9) is a chemical compound with molecular formula C17H20N4O5 and molecular weight 360.4 g/mol. Its IUPAC systematic name is [(7R,8S)-11-(aziridin-1-yl)-7-methoxy-12-methyl-10,13-dioxo-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl]methyl carbamate. LogP 0.2 Topological Polar Surface Area 124.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 8 Rotatable Bonds 5 Exact Mass 360.14337 Heavy Atoms 26 Complexity 829.0 InChI Key: FKJOSOXAGBHNJN-QNTWZPOASA-N. SMILES: CC1=C(C(=O)C2=C(C1=O)N3CC4C(C3(C2COC(=O)N)OC)N4)N5CC5.

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