1-(9H-carbazol-4-yloxy)-3-[4-(1,3-thiazol-2-ylmethyl)piperazin-1-yl]propan-2-ol

C23H26N4O2S — CID 16730732

IUPAC1-(9H-carbazol-4-yloxy)-3-[4-(1,3-thiazol-2-ylmethyl)piperazin-1-yl]propan-2-ol
SMILESOC(COc1cccc2[nH]c3ccccc3c12)CN1CCN(Cc2nccs2)CC1
InChIInChI=1S/C23H26N4O2S/c28-17(14-26-9-11-27(12-10-26)15-22-24-8-13-30-22)16-29-21-7-3-6-20-23(21)18-4-1-2-5-19(18)25-20/h1-8,13,17,25,28H,9-12,14-16H2
InChIKeyRAIDLOIUYRYVAZ-UHFFFAOYSA-N
MW422.55 g/mol
LogP3.34
Rot. Bonds7

About 1-(9H-carbazol-4-yloxy)-3-[4-(1,3-thiazol-2-ylmethyl)piperazin-1-yl]propan-2-ol

1-(9H-carbazol-4-yloxy)-3-[4-(1,3-thiazol-2-ylmethyl)piperazin-1-yl]propan-2-ol (PubChem CID 16730732) has the molecular formula C23H26N4O2S and a molecular weight of 422.55 g/mol. Its IUPAC name is 1-(9H-carbazol-4-yloxy)-3-[4-(1,3-thiazol-2-ylmethyl)piperazin-1-yl]propan-2-ol.

Molecular Properties

Compound Name1-(9H-carbazol-4-yloxy)-3-[4-(1,3-thiazol-2-ylmethyl)piperazin-1-yl]propan-2-ol
PubChem CID16730732
Molecular FormulaC23H26N4O2S
Molecular Weight422.55 g/mol
Exact Mass422.18
IUPAC Name1-(9H-carbazol-4-yloxy)-3-[4-(1,3-thiazol-2-ylmethyl)piperazin-1-yl]propan-2-ol
SMILESOC(COc1cccc2[nH]c3ccccc3c12)CN1CCN(Cc2nccs2)CC1
InChIInChI=1S/C23H26N4O2S/c28-17(14-26-9-11-27(12-10-26)15-22-24-8-13-30-22)16-29-21-7-3-6-20-23(21)18-4-1-2-5-19(18)25-20/h1-8,13,17,25,28H,9-12,14-16H2
InChIKeyRAIDLOIUYRYVAZ-UHFFFAOYSA-N
XLogP3.34
TPSA64.62 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.55
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 1-(9H-carbazol-4-yloxy)-3-[4-(1,3-thiazol-2-ylmethyl)piperazin-1-yl]propan-2-ol with MolForge

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Related Compounds

[4-[3-(9H-carbazol-4-yloxy)-2-hydroxypropyl]piperazin-1-yl]-thiophen-2-ylmethanone
CID 16730886
1,3-bis(9H-carbazol-4-yloxy)propan-2-ol
CID 71314054
1-[4-[3-(9H-carbazol-4-yloxy)-2-hydroxypropyl]piperazin-1-yl]-2-pyridin-3-ylethanone
CID 16730970
1-(9H-carbazol-4-yloxy)-3-[4-[(2-methoxyphenoxy)methyl]piperidin-1-yl]propan-2-ol;hydrochloride
CID 162317183
1-(9H-carbazol-4-yloxy)-3-[4-[(2-methylphenoxy)methyl]piperidin-1-yl]propan-2-ol;hydrochloride
CID 162308822
1-(9H-carbazol-4-yloxy)-3-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]propan-2-ol
CID 74322819
(2R)-1-(9H-carbazol-4-yloxy)butan-2-ol
CID 58878130
2-[[1-[3-(9H-carbazol-4-yloxy)-2-hydroxypropyl]piperidin-4-yl]methyl]benzo[de]isoquinoline-1,3-dione
CID 46889670
2-[3-(9H-carbazol-4-yloxy)-2-hydroxypropyl]guanidine
CID 162659566
1-(2-hydroxy-3-naphthalen-1-yloxypropyl)-1,4-diazepan-5-one
CID 110882982
1-(9H-carbazol-4-yloxy)-3-[2-(2-methoxyphenoxy)ethylamino]propan-2-ol
CID 2585
1-[1-[3-(9H-carbazol-4-yloxy)-2-hydroxypropyl]-4-(2,3,4,5,6-pentafluorophenyl)piperazin-2-yl]ethanone
CID 16730966

Frequently Asked Questions

What is the IUPAC name of 1-(9H-carbazol-4-yloxy)-3-[4-(1,3-thiazol-2-ylmethyl)piperazin-1-yl]propan-2-ol?
The IUPAC name of 1-(9H-carbazol-4-yloxy)-3-[4-(1,3-thiazol-2-ylmethyl)piperazin-1-yl]propan-2-ol (CID 16730732) is 1-(9H-carbazol-4-yloxy)-3-[4-(1,3-thiazol-2-ylmethyl)piperazin-1-yl]propan-2-ol.
What is the SMILES notation for 1-(9H-carbazol-4-yloxy)-3-[4-(1,3-thiazol-2-ylmethyl)piperazin-1-yl]propan-2-ol?
The canonical SMILES for 1-(9H-carbazol-4-yloxy)-3-[4-(1,3-thiazol-2-ylmethyl)piperazin-1-yl]propan-2-ol is OC(COc1cccc2[nH]c3ccccc3c12)CN1CCN(Cc2nccs2)CC1.
What is the InChIKey of 1-(9H-carbazol-4-yloxy)-3-[4-(1,3-thiazol-2-ylmethyl)piperazin-1-yl]propan-2-ol?
The InChIKey is RAIDLOIUYRYVAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O2S/c28-17(14-26-9-11-27(12-10-26)15-22-24-8-13-30-22)16-29-21-7-3-6-20-23(21)18-4-1-2-5-19(18)25-20/h1-8,13,17,25,28H,9-12,14-16H2.
What are the key properties of 1-(9H-carbazol-4-yloxy)-3-[4-(1,3-thiazol-2-ylmethyl)piperazin-1-yl]propan-2-ol?
1-(9H-carbazol-4-yloxy)-3-[4-(1,3-thiazol-2-ylmethyl)piperazin-1-yl]propan-2-ol has a molecular weight of 422.55 g/mol, XLogP of 3.34, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(9H-carbazol-4-yloxy)-3-[4-(1,3-thiazol-2-ylmethyl)piperazin-1-yl]propan-2-ol is sourced from PubChem (CID 16730732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).