4-[(3R)-7,8-dimethoxy-3,4-dihydro-2H-chromen-3-yl]phenol

C17H18O4 — CID 124578570

IUPAC4-[(3R)-7,8-dimethoxy-3,4-dihydro-2H-chromen-3-yl]phenol
SMILESCOc1ccc2c(c1OC)OC[C@@H](c1ccc(O)cc1)C2
InChIInChI=1S/C17H18O4/c1-19-15-8-5-12-9-13(10-21-16(12)17(15)20-2)11-3-6-14(18)7-4-11/h3-8,13,18H,9-10H2,1-2H3/t13-/m0/s1
InChIKeyMARBQBXDZYHIEP-ZDUSSCGKSA-N
MW286.33 g/mol
LogP3.13
Rot. Bonds3

About 4-[(3R)-7,8-dimethoxy-3,4-dihydro-2H-chromen-3-yl]phenol

4-[(3R)-7,8-dimethoxy-3,4-dihydro-2H-chromen-3-yl]phenol (PubChem CID 124578570) has the molecular formula C17H18O4 and a molecular weight of 286.33 g/mol. Its IUPAC name is 4-[(3R)-7,8-dimethoxy-3,4-dihydro-2H-chromen-3-yl]phenol.

Molecular Properties

Compound Name4-[(3R)-7,8-dimethoxy-3,4-dihydro-2H-chromen-3-yl]phenol
PubChem CID124578570
Molecular FormulaC17H18O4
Molecular Weight286.33 g/mol
Exact Mass286.12
IUPAC Name4-[(3R)-7,8-dimethoxy-3,4-dihydro-2H-chromen-3-yl]phenol
SMILESCOc1ccc2c(c1OC)OC[C@@H](c1ccc(O)cc1)C2
InChIInChI=1S/C17H18O4/c1-19-15-8-5-12-9-13(10-21-16(12)17(15)20-2)11-3-6-14(18)7-4-11/h3-8,13,18H,9-10H2,1-2H3/t13-/m0/s1
InChIKeyMARBQBXDZYHIEP-ZDUSSCGKSA-N
XLogP3.13
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-[(3R)-7,8-dimethoxy-3,4-dihydro-2H-chromen-3-yl]phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-methoxy-3-(4-methoxyphenyl)-3,4-dihydro-2H-chromen-8-ol
CID 42604484
(3S)-3-(2-hydroxy-3,4-dimethoxyphenyl)-8-methoxy-3,4-dihydro-2H-chromen-7-ol
CID 163043371
3-(7-hydroxy-8-methoxy-3,4-dihydro-2H-chromen-3-yl)-6-methoxybenzene-1,2-diol
CID 5326313
3-(3,4-dimethoxyphenyl)-3,4-dihydro-2H-chromen-7-ol
CID 42604621
(3S)-8-methoxy-3-(2,4,5-trimethoxyphenyl)-3,4-dihydro-2H-chromen-7-ol
CID 70252444
ethyl 7,8-dimethoxy-3,4-dihydro-2H-chromene-3-carboxylate
CID 170902617
(2R,3R)-2-(4-hydroxyphenyl)-7-methoxy-8-methyl-3,4-dihydro-2H-chromen-3-ol
CID 637885
2,3-dimethoxy-6-(7-methoxy-3,4-dihydro-2H-chromen-3-yl)phenol
CID 5319689
[8-[dihydroxy(phenyl)methyl]-3-(3,4-dimethoxyphenyl)-3,4-dihydro-2H-chromen-7-yl]-phenylmethanediol
CID 70393683
3-(4-hydroxy-2-methoxyphenyl)-3,4-dihydro-2H-chromen-7-ol
CID 591830
4-[(3S)-7-methoxy-8-methyl-3,4-dihydro-2H-chromen-3-yl]-3-(3-methoxyphenyl)phenol
CID 166888963
7-methoxy-3-phenyl-3,4-dihydro-2H-chromen-6-ol
CID 15628202

Frequently Asked Questions

What is the IUPAC name of 4-[(3R)-7,8-dimethoxy-3,4-dihydro-2H-chromen-3-yl]phenol?
The IUPAC name of 4-[(3R)-7,8-dimethoxy-3,4-dihydro-2H-chromen-3-yl]phenol (CID 124578570) is 4-[(3R)-7,8-dimethoxy-3,4-dihydro-2H-chromen-3-yl]phenol.
What is the SMILES notation for 4-[(3R)-7,8-dimethoxy-3,4-dihydro-2H-chromen-3-yl]phenol?
The canonical SMILES for 4-[(3R)-7,8-dimethoxy-3,4-dihydro-2H-chromen-3-yl]phenol is COc1ccc2c(c1OC)OC[C@@H](c1ccc(O)cc1)C2.
What is the InChIKey of 4-[(3R)-7,8-dimethoxy-3,4-dihydro-2H-chromen-3-yl]phenol?
The InChIKey is MARBQBXDZYHIEP-ZDUSSCGKSA-N. The full InChI is InChI=1S/C17H18O4/c1-19-15-8-5-12-9-13(10-21-16(12)17(15)20-2)11-3-6-14(18)7-4-11/h3-8,13,18H,9-10H2,1-2H3/t13-/m0/s1.
What are the key properties of 4-[(3R)-7,8-dimethoxy-3,4-dihydro-2H-chromen-3-yl]phenol?
4-[(3R)-7,8-dimethoxy-3,4-dihydro-2H-chromen-3-yl]phenol has a molecular weight of 286.33 g/mol, XLogP of 3.13, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3R)-7,8-dimethoxy-3,4-dihydro-2H-chromen-3-yl]phenol is sourced from PubChem (CID 124578570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).