Dipyridodiazepinone deriv. 24

HCID 463151
Substructure searchFind similar structures

Basic information

Standard SMILES
CCN1c2ncccc2C(=O)Nc2c(C)cc(NCCCO)nc21
InChIKey
SGXFRGLRYZSEDC-UHFFFAOYSA-N
Molecular formula
C17H21N5O2
Average molar mass
327.4 g/mol

Names & identifiers

Preferred name
Dipyridodiazepinone deriv. 24
IUPAC
2-ethyl-5-(3-hydroxypropylamino)-7-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one

Names & synonyms

Dipyridodiazepinone deriv. 24BDBM1537CHEMBL343625SCHEMBL8889187SGXFRGLRYZSEDC-UHFFFAOYSA-N11-ethyl-2-(3-hydroxypropylamino)-4-methyl-5H-dipyrido[[?],[?]][1,4]diazepin-6-one11-Ethyl-2-[(3-hydroxypropyl)amino]-4-methyl-5,11-dihydro-6H-dipyrido[2,3-e:3',2'-b][1,4]diazepin-6-one2-ethyl-5-[(3-hydroxypropyl)amino]-7-methyl-2,4,9,15-tetraazatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3,5,7,12,14-hexaen-10-one5,11-Dihydro-11-ethyl-2-(3-hydroxypropyl)amino-4-methyl-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one

Database identifiers

PubChem CID
463151
ChEMBL
CHEMBL343625

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
90.4 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
24

Related reactions

2 records
New reaction record

Linked notes

Loading…