N-phenyl-2-(4-phenylpiperazin-1-yl)-6,7-dihydrothieno[3,2-d]pyrimidin-4-amine

C22H23N5S — CID 11956657

IUPACN-phenyl-2-(4-phenylpiperazin-1-yl)-6,7-dihydrothieno[3,2-d]pyrimidin-4-amine
SMILESc1ccc(Nc2nc(N3CCN(c4ccccc4)CC3)nc3c2SCC3)cc1
InChIInChI=1S/C22H23N5S/c1-3-7-17(8-4-1)23-21-20-19(11-16-28-20)24-22(25-21)27-14-12-26(13-15-27)18-9-5-2-6-10-18/h1-10H,11-16H2,(H,23,24,25)
InChIKeyURFRBDDZRLJPIE-UHFFFAOYSA-N
MW389.53 g/mol
LogP4.20
Rot. Bonds4

About N-phenyl-2-(4-phenylpiperazin-1-yl)-6,7-dihydrothieno[3,2-d]pyrimidin-4-amine

N-phenyl-2-(4-phenylpiperazin-1-yl)-6,7-dihydrothieno[3,2-d]pyrimidin-4-amine (PubChem CID 11956657) has the molecular formula C22H23N5S and a molecular weight of 389.53 g/mol. Its IUPAC name is N-phenyl-2-(4-phenylpiperazin-1-yl)-6,7-dihydrothieno[3,2-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-phenyl-2-(4-phenylpiperazin-1-yl)-6,7-dihydrothieno[3,2-d]pyrimidin-4-amine
PubChem CID11956657
Molecular FormulaC22H23N5S
Molecular Weight389.53 g/mol
Exact Mass389.17
IUPAC NameN-phenyl-2-(4-phenylpiperazin-1-yl)-6,7-dihydrothieno[3,2-d]pyrimidin-4-amine
SMILESc1ccc(Nc2nc(N3CCN(c4ccccc4)CC3)nc3c2SCC3)cc1
InChIInChI=1S/C22H23N5S/c1-3-7-17(8-4-1)23-21-20-19(11-16-28-20)24-22(25-21)27-14-12-26(13-15-27)18-9-5-2-6-10-18/h1-10H,11-16H2,(H,23,24,25)
InChIKeyURFRBDDZRLJPIE-UHFFFAOYSA-N
XLogP4.20
TPSA44.29 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.53
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-[4-(cyclohexylamino)-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-N-phenylpiperazine-1-carboxamide
CID 91087895
4-(4-methoxyanilino)-2-(4-phenylpiperazin-1-yl)-7,8-dihydro-6H-quinazolin-5-one
CID 30316343
N-(oxan-4-yl)-2-(3-phenylazetidin-1-yl)-6,7-dihydrothieno[3,2-d]pyrimidin-4-amine
CID 138687868
N-(4-methylphenyl)-2-(4-phenylpiperazin-1-yl)pteridin-4-amine
CID 16910730
(2R)-2-N-[2-[4-(4-chlorophenyl)piperazin-1-yl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl]-3-methylbutane-1,2-diamine;2,2,2-trifluoroacetic acid
CID 67491924
N-(3-fluorophenyl)-2-[4-[3-(furan-2-yl)-1H-pyrazol-5-yl]piperidin-1-yl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-amine
CID 143791835
N-phenyl-3-(4-phenylpiperazin-1-yl)-1,2,4-triazin-5-amine
CID 112955539
4-[4-[4-[(1-hydroxy-3-methylbutan-2-yl)amino]-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]piperazin-1-yl]-1H-pyridin-2-one
CID 126734480
2-(4-methylpiperazin-1-yl)-N-phenylquinazolin-4-amine
CID 25178130
N-(4-methylphenyl)-1-phenyl-6-(4-phenylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-4-amine
CID 17016838
4-anilino-2-[4-(4-fluorophenyl)piperazin-1-yl]-7-thiophen-2-yl-7,8-dihydro-6H-quinazolin-5-one
CID 43902951
2,4-dichloro-6-(4-phenylpiperazin-1-yl)-1,3,5-triazine
CID 62859583

Frequently Asked Questions

What is the IUPAC name of N-phenyl-2-(4-phenylpiperazin-1-yl)-6,7-dihydrothieno[3,2-d]pyrimidin-4-amine?
The IUPAC name of N-phenyl-2-(4-phenylpiperazin-1-yl)-6,7-dihydrothieno[3,2-d]pyrimidin-4-amine (CID 11956657) is N-phenyl-2-(4-phenylpiperazin-1-yl)-6,7-dihydrothieno[3,2-d]pyrimidin-4-amine.
What is the SMILES notation for N-phenyl-2-(4-phenylpiperazin-1-yl)-6,7-dihydrothieno[3,2-d]pyrimidin-4-amine?
The canonical SMILES for N-phenyl-2-(4-phenylpiperazin-1-yl)-6,7-dihydrothieno[3,2-d]pyrimidin-4-amine is c1ccc(Nc2nc(N3CCN(c4ccccc4)CC3)nc3c2SCC3)cc1.
What is the InChIKey of N-phenyl-2-(4-phenylpiperazin-1-yl)-6,7-dihydrothieno[3,2-d]pyrimidin-4-amine?
The InChIKey is URFRBDDZRLJPIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N5S/c1-3-7-17(8-4-1)23-21-20-19(11-16-28-20)24-22(25-21)27-14-12-26(13-15-27)18-9-5-2-6-10-18/h1-10H,11-16H2,(H,23,24,25).
What are the key properties of N-phenyl-2-(4-phenylpiperazin-1-yl)-6,7-dihydrothieno[3,2-d]pyrimidin-4-amine?
N-phenyl-2-(4-phenylpiperazin-1-yl)-6,7-dihydrothieno[3,2-d]pyrimidin-4-amine has a molecular weight of 389.53 g/mol, XLogP of 4.20, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-2-(4-phenylpiperazin-1-yl)-6,7-dihydrothieno[3,2-d]pyrimidin-4-amine is sourced from PubChem (CID 11956657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).