7-phenylmethoxy-3-(6-phenylmethoxy-1,3-benzodioxol-5-yl)-2H-chromene

C30H24O5 — CID 11005099

IUPAC7-phenylmethoxy-3-(6-phenylmethoxy-1,3-benzodioxol-5-yl)-2H-chromene
SMILESC1=C(c2cc3c(cc2OCc2ccccc2)OCO3)COc2cc(OCc3ccccc3)ccc21
InChIInChI=1S/C30H24O5/c1-3-7-21(8-4-1)17-31-25-12-11-23-13-24(19-33-27(23)14-25)26-15-29-30(35-20-34-29)16-28(26)32-18-22-9-5-2-6-10-22/h1-16H,17-20H2
InChIKeyMYDQLKCBNGYZQD-UHFFFAOYSA-N
MW464.52 g/mol
LogP6.51
Rot. Bonds7

About 7-phenylmethoxy-3-(6-phenylmethoxy-1,3-benzodioxol-5-yl)-2H-chromene

7-phenylmethoxy-3-(6-phenylmethoxy-1,3-benzodioxol-5-yl)-2H-chromene (PubChem CID 11005099) has the molecular formula C30H24O5 and a molecular weight of 464.52 g/mol. Its IUPAC name is 7-phenylmethoxy-3-(6-phenylmethoxy-1,3-benzodioxol-5-yl)-2H-chromene.

Molecular Properties

Compound Name7-phenylmethoxy-3-(6-phenylmethoxy-1,3-benzodioxol-5-yl)-2H-chromene
PubChem CID11005099
Molecular FormulaC30H24O5
Molecular Weight464.52 g/mol
Exact Mass464.16
IUPAC Name7-phenylmethoxy-3-(6-phenylmethoxy-1,3-benzodioxol-5-yl)-2H-chromene
SMILESC1=C(c2cc3c(cc2OCc2ccccc2)OCO3)COc2cc(OCc3ccccc3)ccc21
InChIInChI=1S/C30H24O5/c1-3-7-21(8-4-1)17-31-25-12-11-23-13-24(19-33-27(23)14-25)26-15-29-30(35-20-34-29)16-28(26)32-18-22-9-5-2-6-10-22/h1-16H,17-20H2
InChIKeyMYDQLKCBNGYZQD-UHFFFAOYSA-N
XLogP6.51
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500464.52
LogP ≤ 56.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

Analyze 7-phenylmethoxy-3-(6-phenylmethoxy-1,3-benzodioxol-5-yl)-2H-chromene 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

6-[2,4-bis(phenylmethoxy)phenyl]furo[2,3-f][1,3]benzodioxole
CID 10049428
3,5,7-tris(phenylmethoxy)-2H-chromene
CID 126510429
7-phenylmethoxy-3,4-bis(4-phenylmethoxyphenyl)-2H-chromene
CID 67497871
3-(4-chloro-2-phenylmethoxyphenyl)-2H-furan-5-one
CID 23463125
[6-(3-methoxy-4-phenylmethoxyphenyl)-1,3-benzodioxol-5-yl]methanol
CID 10948495
N-(1,3-benzodioxol-5-ylmethyl)-1-(4-phenylmethoxyphenyl)methanamine;hydrochloride
CID 17291782
4-(8,8-dimethyl-2H-pyrano[2,3-f]chromen-3-yl)-3-phenylmethoxyphenol
CID 134419112
4-phenylmethoxy-1,3-benzodioxole
CID 14180566
7-[(4-propylphenyl)methoxy]-2H-chromene-3-carbaldehyde
CID 58439114
(2R,10S)-10-amino-2-(7-phenylmethoxy-2H-chromen-3-yl)-1,3-diazatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-4-one
CID 11568361
3,3-dimethyl-2H-1-benzofuran-6-ol;3,3-dimethyl-6-phenylmethoxy-2H-1-benzofuran
CID 157225456
6-methoxy-3-(6-methoxy-1,3-benzodioxol-5-yl)-4-methoxyimino-7-phenylmethoxy-2,3-dihydronaphthalen-1-one
CID 139985414

Frequently Asked Questions

What is the IUPAC name of 7-phenylmethoxy-3-(6-phenylmethoxy-1,3-benzodioxol-5-yl)-2H-chromene?
The IUPAC name of 7-phenylmethoxy-3-(6-phenylmethoxy-1,3-benzodioxol-5-yl)-2H-chromene (CID 11005099) is 7-phenylmethoxy-3-(6-phenylmethoxy-1,3-benzodioxol-5-yl)-2H-chromene.
What is the SMILES notation for 7-phenylmethoxy-3-(6-phenylmethoxy-1,3-benzodioxol-5-yl)-2H-chromene?
The canonical SMILES for 7-phenylmethoxy-3-(6-phenylmethoxy-1,3-benzodioxol-5-yl)-2H-chromene is C1=C(c2cc3c(cc2OCc2ccccc2)OCO3)COc2cc(OCc3ccccc3)ccc21.
What is the InChIKey of 7-phenylmethoxy-3-(6-phenylmethoxy-1,3-benzodioxol-5-yl)-2H-chromene?
The InChIKey is MYDQLKCBNGYZQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H24O5/c1-3-7-21(8-4-1)17-31-25-12-11-23-13-24(19-33-27(23)14-25)26-15-29-30(35-20-34-29)16-28(26)32-18-22-9-5-2-6-10-22/h1-16H,17-20H2.
What are the key properties of 7-phenylmethoxy-3-(6-phenylmethoxy-1,3-benzodioxol-5-yl)-2H-chromene?
7-phenylmethoxy-3-(6-phenylmethoxy-1,3-benzodioxol-5-yl)-2H-chromene has a molecular weight of 464.52 g/mol, XLogP of 6.51, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-phenylmethoxy-3-(6-phenylmethoxy-1,3-benzodioxol-5-yl)-2H-chromene is sourced from PubChem (CID 11005099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).