[1-(2-Chloro-6,7-dihydrothieno[3,2-d]pyrimidin-4-ylamino)-cyclopropyl]-methanol

HCID 59708441

Notes Reactions

Substructure search Find similar structures

Basic information

Standard SMILES: OCC1(Nc2nc(Cl)nc3c2SCC3)CC1
InChIKey: BYDOBYHACJNKAF-UHFFFAOYSA-N
Molecular formula: C10H12ClN3OS
Average molar mass: 257.74 g/mol

Names & identifiers

Preferred name: [1-(2-Chloro-6,7-dihydrothieno[3,2-d]pyrimidin-4-ylamino)-cyclopropyl]-methanol
IUPAC: [1-[(2-chloro-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl)amino]cyclopropyl]methanol

Names & synonyms

SCHEMBL373964BYDOBYHACJNKAF-UHFFFAOYSA-N[1-(2-chloro-6,7-dihydrothieno[3,2-d]pyrimidin-4-ylamino)-cyclopropyl]-methanol

Database identifiers

PubChem CID: 59708441

Properties

Computed structural properties

XLogP: 1.8
Topological polar surface area: 83.3 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 5
Rotatable bonds: 3
Heavy atoms: 16
Formal charge: 0
Complexity: 277

Related reactions

9 records

New reaction record

HRID 101818As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

HRID 405905As productuspto-grants-2014_06

HRID 408087As productuspto-grants-2014_06

HRID 449856As productuspto-grants-2013_07

HRID 474159As productuspto-grants-2014_01

HRID 518016As productuspto-grants-2015_08

HRID 1129593As reactantTraining data from https://doi.org/10.1039/C8SC04228D (7/10)

HRID 1529507As productuspto-grants-2015_07

Compound notes

Loading…