2-[2,3-bis[4-[3,4-bis[4-[2,5-dipyridin-2-yl-3,4-bis[4-(2,3,4,5-tetraphenylphenyl)phenyl]phenyl]phenyl]-2,5-dipyridin-2-ylphenyl]phenyl]-5-(4-methylphenyl)-4-pyridin-2-ylphenyl]pyridine

C443H294N14 — CID 58114874

IUPAC2-[2,3-bis[4-[3,4-bis[4-[2,5-dipyridin-2-yl-3,4-bis[4-(2,3,4,5-tetraphenylphenyl)phenyl]phenyl]phenyl]-2,5-dipyridin-2-ylphenyl]phenyl]-5-(4-methylphenyl)-4-pyridin-2-ylphenyl]pyridine
SMILESCc1ccc(-c2cc(-c3ccccn3)c(-c3ccc(-c4cc(-c5ccccn5)c(-c5ccc(-c6cc(-c7ccccn7)c(-c7ccc(-c8cc(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c8-c8ccccc8)cc7)c(-c7ccc(-c8cc(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c8-c8ccccc8)cc7)c6-c6ccccn6)cc5)c(-c5ccc(-c6cc(-c7ccccn7)c(-c7ccc(-c8cc(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c8-c8ccccc8)cc7)c(-c7ccc(-c8cc(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c8-c8ccccc8)cc7)c6-c6ccccn6)cc5)c4-c4ccccn4)cc3)c(-c3ccc(-c4cc(-c5ccccn5)c(-c5ccc(-c6cc(-c7ccccn7)c(-c7ccc(-c8cc(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c8-c8ccccc8)cc7)c(-c7ccc(-c8cc(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c8-c8ccccc8)cc7)c6-c6ccccn6)cc5)c(-c5ccc(-c6cc(-c7ccccn7)c(-c7ccc(-c8cc(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c8-c8ccccc8)cc7)c(-c7ccc(-c8cc(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c8-c8ccccc8)cc7)c6-c6ccccn6)cc5)c4-c4ccccn4)cc3)c2-c2ccccn2)cc1
InChIInChI=1S/C443H294N14/c1-293-204-206-302(207-205-293)371-286-378(385-190-98-112-264-444-385)419(345-244-216-313(217-245-345)374-289-381(388-193-101-115-267-447-388)420(346-246-218-311(219-247-346)372-287-379(386-191-99-113-265-445-386)415(341-236-208-303(209-237-341)363-278-355(294-126-34-2-35-127-294)399(317-142-50-10-51-143-317)422(333-174-82-26-83-175-333)407(363)325-158-66-18-67-159-325)431(438(372)393-198-106-120-272-452-393)348-250-222-307(223-251-348)367-282-359(298-134-42-6-43-135-298)403(321-150-58-14-59-151-321)426(337-182-90-30-91-183-337)411(367)329-166-74-22-75-167-329)435(440(374)395-200-108-122-274-454-395)353-260-232-315(233-261-353)375-290-382(389-194-102-116-268-448-389)417(343-240-212-305(213-241-343)365-280-357(296-130-38-4-39-131-296)401(319-146-54-12-55-147-319)424(335-178-86-28-87-179-335)409(365)327-162-70-20-71-163-327)433(441(375)396-201-109-123-275-455-396)350-254-226-309(227-255-350)369-284-361(300-138-46-8-47-139-300)405(323-154-62-16-63-155-323)428(339-186-94-32-95-187-339)413(369)331-170-78-24-79-171-331)430(437(371)392-197-105-119-271-451-392)352-258-230-314(231-259-352)377-292-384(391-196-104-118-270-450-391)421(347-248-220-312(221-249-347)373-288-380(387-192-100-114-266-446-387)416(342-238-210-304(211-239-342)364-279-356(295-128-36-3-37-129-295)400(318-144-52-11-53-145-318)423(334-176-84-27-85-177-334)408(364)326-160-68-19-69-161-326)432(439(373)394-199-107-121-273-453-394)349-252-224-308(225-253-349)368-283-360(299-136-44-7-45-137-299)404(322-152-60-15-61-153-322)427(338-184-92-31-93-185-338)412(368)330-168-76-23-77-169-330)436(443(377)398-203-111-125-277-457-398)354-262-234-316(235-263-354)376-291-383(390-195-103-117-269-449-390)418(344-242-214-306(215-243-344)366-281-358(297-132-40-5-41-133-297)402(320-148-56-13-57-149-320)425(336-180-88-29-89-181-336)410(366)328-164-72-21-73-165-328)434(442(376)397-202-110-124-276-456-397)351-256-228-310(229-257-351)370-285-362(301-140-48-9-49-141-301)406(324-156-64-17-65-157-324)429(340-188-96-33-97-189-340)414(370)332-172-80-25-81-173-332/h2-292H,1H3
InChIKeyVSDSPLGAHRRREJ-UHFFFAOYSA-N
MW5813.32 g/mol
LogP118.55
Rot. Bonds75

About 2-[2,3-bis[4-[3,4-bis[4-[2,5-dipyridin-2-yl-3,4-bis[4-(2,3,4,5-tetraphenylphenyl)phenyl]phenyl]phenyl]-2,5-dipyridin-2-ylphenyl]phenyl]-5-(4-methylphenyl)-4-pyridin-2-ylphenyl]pyridine

2-[2,3-bis[4-[3,4-bis[4-[2,5-dipyridin-2-yl-3,4-bis[4-(2,3,4,5-tetraphenylphenyl)phenyl]phenyl]phenyl]-2,5-dipyridin-2-ylphenyl]phenyl]-5-(4-methylphenyl)-4-pyridin-2-ylphenyl]pyridine (PubChem CID 58114874) has the molecular formula C443H294N14 and a molecular weight of 5813.32 g/mol. Its IUPAC name is 2-[2,3-bis[4-[3,4-bis[4-[2,5-dipyridin-2-yl-3,4-bis[4-(2,3,4,5-tetraphenylphenyl)phenyl]phenyl]phenyl]-2,5-dipyridin-2-ylphenyl]phenyl]-5-(4-methylphenyl)-4-pyridin-2-ylphenyl]pyridine.

Molecular Properties

Compound Name2-[2,3-bis[4-[3,4-bis[4-[2,5-dipyridin-2-yl-3,4-bis[4-(2,3,4,5-tetraphenylphenyl)phenyl]phenyl]phenyl]-2,5-dipyridin-2-ylphenyl]phenyl]-5-(4-methylphenyl)-4-pyridin-2-ylphenyl]pyridine
PubChem CID58114874
Molecular FormulaC443H294N14
Molecular Weight5813.32 g/mol
Exact Mass5808.34
IUPAC Name2-[2,3-bis[4-[3,4-bis[4-[2,5-dipyridin-2-yl-3,4-bis[4-(2,3,4,5-tetraphenylphenyl)phenyl]phenyl]phenyl]-2,5-dipyridin-2-ylphenyl]phenyl]-5-(4-methylphenyl)-4-pyridin-2-ylphenyl]pyridine
SMILESCc1ccc(-c2cc(-c3ccccn3)c(-c3ccc(-c4cc(-c5ccccn5)c(-c5ccc(-c6cc(-c7ccccn7)c(-c7ccc(-c8cc(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c8-c8ccccc8)cc7)c(-c7ccc(-c8cc(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c8-c8ccccc8)cc7)c6-c6ccccn6)cc5)c(-c5ccc(-c6cc(-c7ccccn7)c(-c7ccc(-c8cc(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c8-c8ccccc8)cc7)c(-c7ccc(-c8cc(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c8-c8ccccc8)cc7)c6-c6ccccn6)cc5)c4-c4ccccn4)cc3)c(-c3ccc(-c4cc(-c5ccccn5)c(-c5ccc(-c6cc(-c7ccccn7)c(-c7ccc(-c8cc(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c8-c8ccccc8)cc7)c(-c7ccc(-c8cc(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c8-c8ccccc8)cc7)c6-c6ccccn6)cc5)c(-c5ccc(-c6cc(-c7ccccn7)c(-c7ccc(-c8cc(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c8-c8ccccc8)cc7)c(-c7ccc(-c8cc(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c8-c8ccccc8)cc7)c6-c6ccccn6)cc5)c4-c4ccccn4)cc3)c2-c2ccccn2)cc1
InChIInChI=1S/C443H294N14/c1-293-204-206-302(207-205-293)371-286-378(385-190-98-112-264-444-385)419(345-244-216-313(217-245-345)374-289-381(388-193-101-115-267-447-388)420(346-246-218-311(219-247-346)372-287-379(386-191-99-113-265-445-386)415(341-236-208-303(209-237-341)363-278-355(294-126-34-2-35-127-294)399(317-142-50-10-51-143-317)422(333-174-82-26-83-175-333)407(363)325-158-66-18-67-159-325)431(438(372)393-198-106-120-272-452-393)348-250-222-307(223-251-348)367-282-359(298-134-42-6-43-135-298)403(321-150-58-14-59-151-321)426(337-182-90-30-91-183-337)411(367)329-166-74-22-75-167-329)435(440(374)395-200-108-122-274-454-395)353-260-232-315(233-261-353)375-290-382(389-194-102-116-268-448-389)417(343-240-212-305(213-241-343)365-280-357(296-130-38-4-39-131-296)401(319-146-54-12-55-147-319)424(335-178-86-28-87-179-335)409(365)327-162-70-20-71-163-327)433(441(375)396-201-109-123-275-455-396)350-254-226-309(227-255-350)369-284-361(300-138-46-8-47-139-300)405(323-154-62-16-63-155-323)428(339-186-94-32-95-187-339)413(369)331-170-78-24-79-171-331)430(437(371)392-197-105-119-271-451-392)352-258-230-314(231-259-352)377-292-384(391-196-104-118-270-450-391)421(347-248-220-312(221-249-347)373-288-380(387-192-100-114-266-446-387)416(342-238-210-304(211-239-342)364-279-356(295-128-36-3-37-129-295)400(318-144-52-11-53-145-318)423(334-176-84-27-85-177-334)408(364)326-160-68-19-69-161-326)432(439(373)394-199-107-121-273-453-394)349-252-224-308(225-253-349)368-283-360(299-136-44-7-45-137-299)404(322-152-60-15-61-153-322)427(338-184-92-31-93-185-338)412(368)330-168-76-23-77-169-330)436(443(377)398-203-111-125-277-457-398)354-262-234-316(235-263-354)376-291-383(390-195-103-117-269-449-390)418(344-242-214-306(215-243-344)366-281-358(297-132-40-5-41-133-297)402(320-148-56-13-57-149-320)425(336-180-88-29-89-181-336)410(366)328-164-72-21-73-165-328)434(442(376)397-202-110-124-276-456-397)351-256-228-310(229-257-351)370-285-362(301-140-48-9-49-141-301)406(324-156-64-17-65-157-324)429(340-188-96-33-97-189-340)414(370)332-172-80-25-81-173-332/h2-292H,1H3
InChIKeyVSDSPLGAHRRREJ-UHFFFAOYSA-N
XLogP118.55
TPSA180.46 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds75
Heavy Atoms457
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005813.32
LogP ≤ 5118.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Analyze 2-[2,3-bis[4-[3,4-bis[4-[2,5-dipyridin-2-yl-3,4-bis[4-(2,3,4,5-tetraphenylphenyl)phenyl]phenyl]phenyl]-2,5-dipyridin-2-ylphenyl]phenyl]-5-(4-methylphenyl)-4-pyridin-2-ylphenyl]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[2,3-bis[4-[3,4-bis[4-[2,5-dipyridin-2-yl-3,4-bis[4-(2,3,4,5-tetraphenylphenyl)phenyl]phenyl]phenyl]-2,5-dipyridin-2-ylphenyl]phenyl]-5-(4-methylphenyl)-4-pyridin-2-ylphenyl]pyridine?
The IUPAC name of 2-[2,3-bis[4-[3,4-bis[4-[2,5-dipyridin-2-yl-3,4-bis[4-(2,3,4,5-tetraphenylphenyl)phenyl]phenyl]phenyl]-2,5-dipyridin-2-ylphenyl]phenyl]-5-(4-methylphenyl)-4-pyridin-2-ylphenyl]pyridine (CID 58114874) is 2-[2,3-bis[4-[3,4-bis[4-[2,5-dipyridin-2-yl-3,4-bis[4-(2,3,4,5-tetraphenylphenyl)phenyl]phenyl]phenyl]-2,5-dipyridin-2-ylphenyl]phenyl]-5-(4-methylphenyl)-4-pyridin-2-ylphenyl]pyridine.
What is the SMILES notation for 2-[2,3-bis[4-[3,4-bis[4-[2,5-dipyridin-2-yl-3,4-bis[4-(2,3,4,5-tetraphenylphenyl)phenyl]phenyl]phenyl]-2,5-dipyridin-2-ylphenyl]phenyl]-5-(4-methylphenyl)-4-pyridin-2-ylphenyl]pyridine?
The canonical SMILES for 2-[2,3-bis[4-[3,4-bis[4-[2,5-dipyridin-2-yl-3,4-bis[4-(2,3,4,5-tetraphenylphenyl)phenyl]phenyl]phenyl]-2,5-dipyridin-2-ylphenyl]phenyl]-5-(4-methylphenyl)-4-pyridin-2-ylphenyl]pyridine is Cc1ccc(-c2cc(-c3ccccn3)c(-c3ccc(-c4cc(-c5ccccn5)c(-c5ccc(-c6cc(-c7ccccn7)c(-c7ccc(-c8cc(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c8-c8ccccc8)cc7)c(-c7ccc(-c8cc(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c8-c8ccccc8)cc7)c6-c6ccccn6)cc5)c(-c5ccc(-c6cc(-c7ccccn7)c(-c7ccc(-c8cc(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c8-c8ccccc8)cc7)c(-c7ccc(-c8cc(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c8-c8ccccc8)cc7)c6-c6ccccn6)cc5)c4-c4ccccn4)cc3)c(-c3ccc(-c4cc(-c5ccccn5)c(-c5ccc(-c6cc(-c7ccccn7)c(-c7ccc(-c8cc(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c8-c8ccccc8)cc7)c(-c7ccc(-c8cc(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c8-c8ccccc8)cc7)c6-c6ccccn6)cc5)c(-c5ccc(-c6cc(-c7ccccn7)c(-c7ccc(-c8cc(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c8-c8ccccc8)cc7)c(-c7ccc(-c8cc(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c8-c8ccccc8)cc7)c6-c6ccccn6)cc5)c4-c4ccccn4)cc3)c2-c2ccccn2)cc1.
What is the InChIKey of 2-[2,3-bis[4-[3,4-bis[4-[2,5-dipyridin-2-yl-3,4-bis[4-(2,3,4,5-tetraphenylphenyl)phenyl]phenyl]phenyl]-2,5-dipyridin-2-ylphenyl]phenyl]-5-(4-methylphenyl)-4-pyridin-2-ylphenyl]pyridine?
The InChIKey is VSDSPLGAHRRREJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C443H294N14/c1-293-204-206-302(207-205-293)371-286-378(385-190-98-112-264-444-385)419(345-244-216-313(217-245-345)374-289-381(388-193-101-115-267-447-388)420(346-246-218-311(219-247-346)372-287-379(386-191-99-113-265-445-386)415(341-236-208-303(209-237-341)363-278-355(294-126-34-2-35-127-294)399(317-142-50-10-51-143-317)422(333-174-82-26-83-175-333)407(363)325-158-66-18-67-159-325)431(438(372)393-198-106-120-272-452-393)348-250-222-307(223-251-348)367-282-359(298-134-42-6-43-135-298)403(321-150-58-14-59-151-321)426(337-182-90-30-91-183-337)411(367)329-166-74-22-75-167-329)435(440(374)395-200-108-122-274-454-395)353-260-232-315(233-261-353)375-290-382(389-194-102-116-268-448-389)417(343-240-212-305(213-241-343)365-280-357(296-130-38-4-39-131-296)401(319-146-54-12-55-147-319)424(335-178-86-28-87-179-335)409(365)327-162-70-20-71-163-327)433(441(375)396-201-109-123-275-455-396)350-254-226-309(227-255-350)369-284-361(300-138-46-8-47-139-300)405(323-154-62-16-63-155-323)428(339-186-94-32-95-187-339)413(369)331-170-78-24-79-171-331)430(437(371)392-197-105-119-271-451-392)352-258-230-314(231-259-352)377-292-384(391-196-104-118-270-450-391)421(347-248-220-312(221-249-347)373-288-380(387-192-100-114-266-446-387)416(342-238-210-304(211-239-342)364-279-356(295-128-36-3-37-129-295)400(318-144-52-11-53-145-318)423(334-176-84-27-85-177-334)408(364)326-160-68-19-69-161-326)432(439(373)394-199-107-121-273-453-394)349-252-224-308(225-253-349)368-283-360(299-136-44-7-45-137-299)404(322-152-60-15-61-153-322)427(338-184-92-31-93-185-338)412(368)330-168-76-23-77-169-330)436(443(377)398-203-111-125-277-457-398)354-262-234-316(235-263-354)376-291-383(390-195-103-117-269-449-390)418(344-242-214-306(215-243-344)366-281-358(297-132-40-5-41-133-297)402(320-148-56-13-57-149-320)425(336-180-88-29-89-181-336)410(366)328-164-72-21-73-165-328)434(442(376)397-202-110-124-276-456-397)351-256-228-310(229-257-351)370-285-362(301-140-48-9-49-141-301)406(324-156-64-17-65-157-324)429(340-188-96-33-97-189-340)414(370)332-172-80-25-81-173-332/h2-292H,1H3.
What are the key properties of 2-[2,3-bis[4-[3,4-bis[4-[2,5-dipyridin-2-yl-3,4-bis[4-(2,3,4,5-tetraphenylphenyl)phenyl]phenyl]phenyl]-2,5-dipyridin-2-ylphenyl]phenyl]-5-(4-methylphenyl)-4-pyridin-2-ylphenyl]pyridine?
2-[2,3-bis[4-[3,4-bis[4-[2,5-dipyridin-2-yl-3,4-bis[4-(2,3,4,5-tetraphenylphenyl)phenyl]phenyl]phenyl]-2,5-dipyridin-2-ylphenyl]phenyl]-5-(4-methylphenyl)-4-pyridin-2-ylphenyl]pyridine has a molecular weight of 5813.32 g/mol, XLogP of 118.55, 75 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2,3-bis[4-[3,4-bis[4-[2,5-dipyridin-2-yl-3,4-bis[4-(2,3,4,5-tetraphenylphenyl)phenyl]phenyl]phenyl]-2,5-dipyridin-2-ylphenyl]phenyl]-5-(4-methylphenyl)-4-pyridin-2-ylphenyl]pyridine is sourced from PubChem (CID 58114874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).