Basic information
- CAS
17518-97-7- Standard SMILES
Br.O=C(CC1NCCCC1O)Cn1cnc2cc(Cl)c(Br)cc2c1=O- InChIKey
BGPVYCRBEGHEHO-UHFFFAOYSA-N- Molecular formula
- C16H18Br2ClN3O3
- Average molar mass
- 495.6 g/mol
- Monoisotopic mass
- 492.94034
Overview
the 6-bromo,7-chloro-analog of stenorol
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 6-bromo-7-chloro-3-(3-(3-hydroxy-2-piperidinyl)-2-oxopropyl)-, hydrobromide (1:1)
- IUPAC
- 6-bromo-7-chloro-3-[3-(3-hydroxypiperidin-2-yl)-2-oxopropyl]quinazolin-4-one;hydrobromide
- English name
- CP 60949-4
- Molecular formula
- C16H18Br2ClN3O3
- Molecular weight
- 495.6
Names & synonyms
17518-97-7CP-60949-4CP 60949-44(3H)-Quinazolinone, 6-bromo-7-chloro-3-(3-(3-hydroxy-2-piperidinyl)-2-oxopropyl)-, monohydrobromide4(3H)-Quinazolinone, 6-bromo-7-chloro-3-[3-(3-hydroxy-2-piperidinyl)-2-oxopropyl]-, hydrobromide (1:1)4(3H)-Quinazolinone, 6-bromo-7-chloro-3-(3-(3-hydroxy-2-piperidinyl)-2-oxopropyl)-, hydrobromide (1:1)RefChem:9117896-bromo-7-chloro-3-[3-(3-hydroxypiperidin-2-yl)-2-oxopropyl]quinazolin-4-one;hydrobromideorb1697724DTXSID70938629AKOS040751254T31023
Show more names
6-Bromo-7-chloro-3-[3-(3-hydroxypiperidin-2-yl)-2-oxopropyl]quinazolin-4(3H)-one--hydrogen bromide (1/1)
Database identifiers
- CAS
17518-97-7- PubChem CID
- 63128
Properties
Computed structural properties
- Topological polar surface area
- 82 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 533
Chemistry & industry
Applications
DescriptionCP 60949-4 is a bio-active chemical.
Suppliers3 total
BOC Sciences16314854226; +8616314854226 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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